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Profile: Synthese AptoChem Inc. specializes in the custom synthesis of stable labeled and radiolabeled reference standards, test articles, pharmaceuticals & their metabolites. We synthesize a wide variety of small molecules and fine chemicals in the milligram to gram scale. Our custom synthesis services include stable labeled compounds, radiolabeled compounds, active pharmaceutical ingredients, drug metabolites and pharmaceutical impurities & analogs. Our products include atorvastatin lactone, beclomethasone 17-monopropionate, benazeprilate, carboxyterfenadine hydrochloride, carboxyterfenadine, carebastine, cilazaprilat, ciprofloxacin-piperazinyl-n-sulfate, clevidipine metabolite and clopidogrelat.

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• Tenofovir(PMPA)
IUPAC Name: [(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethylphosphonic acid | CAS Registry Number: 147127-20-6
Synonyms: Tenofovir, Apropovir, D,L-Tenofovir, PMPA, GNA & Tenofovir, HHA & Tenofovir, Tenofovir disoproxil, (R)-PMPA, 9-PMPA, PMPA-(R), Tenofovir Disoproxil Fumarate, AIDS021800, AIDS224015, AIDS224022, AIDS-021800, AIDS-224015, AIDS-224022, CID464205, GS1278, DB00300

Molecular Formula: C9H14N5O4PMolecular Weight: 287.212321 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 8

InChIKey: SGOIRFVFHAKUTI-ZCFIWIBFSA-N

• Terazosin
IUPAC Name: [4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone | CAS Registry Number: 63590-64-7
Synonyms: terazosin, Terazosine, Fosfomic, Flumarc, Vasomet, Blavin, Hytrin, Terazosin HCl, Trazosin HCl, Terazosin hydrochloride, Terazosine [INN-French], Terazosinum [INN-Latin], Terazosina [INN-Spanish], Terazosin [INN:BAN], Abbott 45975, Prestwick0_000751, Prestwick1_000751, Prestwick2_000751, Prestwick3_000751, Lopac0_001138

Molecular Formula: C19H25N5O4Molecular Weight: 387.432900 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 8

InChIKey: VCKUSRYTPJJLNI-UHFFFAOYSA-N

• Terbutaline
IUPAC Name: 5-[2-(tert-butylamino)-1-hydroxyethyl]benzene-1,3-diol | CAS Registry Number: 23031-25-6
Synonyms: terbutaline, Terbutalin, Bricaril, Brican, Bricar, Bricyn, Brethaire, Brethine, Bricanyl, Terbutalina [DCIT], (+-)-Terbutaline, Terbutaline sulfate, Terbutalinum [INN-Latin], Terbutalino [INN-Spanish], Spectrum_001030, Terbutaline [INN:BAN], Prestwick0_000391, Prestwick1_000391, Prestwick2_000391, Prestwick3_000391

Molecular Formula: C12H19NO3Molecular Weight: 225.284160 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 4

InChIKey: XWTYSIMOBUGWOL-UHFFFAOYSA-N

• Terfenadine
IUPAC Name: 1-(4-tert-butylphenyl)-4-[4-[hydroxy-di(phenyl)methyl]piperidin-1-yl]butan-1-ol | CAS Registry Number: 50679-08-8
Synonyms: terfenadine, Seldane, Ternadin, Triludan, Teldane, Allerplus, Nebralin, Teldanex, Aldaban, Terdin, Terfen, Terestigmine, Terfenidine, Seldane-D, Prestwick_460, Seldane (TN), Terfenadinum [INN-Latin], Terfenadina [INN-Spanish], Prestwick0_000138, Prestwick1_000138

Molecular Formula: C32H41NO2Molecular Weight: 471.673440 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: GUGOEEXESWIERI-UHFFFAOYSA-N

• Terlipressin
IUPAC Name: (2S)-1-[(1R,4S,7S,10S,13S,16R)-16-[[2-[[2-[(2-aminoacetyl)amino]acetyl]amino]acetyl]amino]-4-(2-amino-2-oxoethyl)-7-(3-amino-3-oxopropyl)-13-[(4-hydroxyphenyl)methyl]-3,6,9,12,15-pentaoxo-10-(phenylmethyl)-18,19-dithia-2,5,8,11,14-pentazacycloicosane-1-carbonyl]-N-[(2S)-6-amino-1-[(2-amino-2-oxoethyl)amino]-1-oxohexan-2-yl]pyrrolidine-2-carboxamide | CAS Registry Number: 14636-12-5
Synonyms: Terlipressin [BAN:INN], Terlipressine [INN-French], Terlipressinum [INN-Latin], Terlipressina [INN-Spanish], EINECS 238-680-8, CID72081, DB02638, LS-161411, N-(N-(N-Glycylglycyl)glycyl)-8-L-lysinevasopressin, (2S)-1-[(4R,7S,10S,13S,16S,19R)-19-[[2-[[2-[(2-aminoacetyl)amino]acetyl]amino]acetyl]amino]-7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-16-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-13-(phenylmethyl)1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]-N-[(2S)-6-amino-1-[(2-amino-2-oxoethyl)amino]-1-oxohexan-2-yl]pyrrolidine-2-carboxamide

Molecular Formula: C52H74N16O15S2Molecular Weight: 1227.372160 [g/mol]
H-Bond Donor: 16H-Bond Acceptor: 17

InChIKey: BENFXAYNYRLAIU-QSVFAHTRSA-N

• Theophylline
IUPAC Name: 1,3-dimethyl-7H-purine-2,6-dione | CAS Registry Number: 58-55-9
Synonyms: theophylline, Elixophyllin, Theophyllin, Theolair, Theocin, Nuelin, Synophylate, Bronkodyl, Aerolate, Theovent, Respbid, Theobid, Uniphyl, 1,3-Dimethylxanthine, Pseudotheophylline, aminophylline, Slo-phyllin, Elixophylline, Liquophylline, Armophylline

Molecular Formula: C7H8N4O2Molecular Weight: 180.164020 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: ZFXYFBGIUFBOJW-UHFFFAOYSA-N

• Thiocolchicoside
IUPAC Name: N-[1,2-dimethoxy-10-methylsulfanyl-9-oxo-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide | CAS Registry Number: 602-41-5
Synonyms: Coltramyl, Musco-ril, 10-Thiocolchicoside, Prestwick_875, Tiocolchicoside [DCIT], Colchicoside, 10-thio-, Prestwick0_000539, Prestwick1_000539, Prestwick2_000539, Prestwick3_000539, Thiocolchicosidum [INN-Latin], Tiocolchicosido [INN-Spanish], Thiocolchicoside [DCF:INN], Thiocolchicoside [INN:DCF], BSPBio_000557, MLS002153865, Thiocolchicine 2-glucoside analog, SPBio_002478, BPBio1_000613, C27H33NO10S

Molecular Formula: C27H33NO10SMolecular Weight: 563.616620 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 10

InChIKey: LEQAKWQJCITZNK-MSQQGMGVSA-N

• Tibolone
IUPAC Name: (7R,8R,9S,13S,14S,17R)-17-ethynyl-17-hydroxy-7,13-dimethyl-1,2,4,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one | CAS Registry Number: 5630-53-5
Synonyms: tibolone, Liviella, Boltin, Livial, Xyvion, Ambap1014, Org-OD14, Tibolone (JAN/USAN/INN), MLS001424234, CID444008, KB-889, CPD000469219, SAM001246801, SMR000469219, TL8003648, D01639, (7beta,8xi,9beta,13alpha,14beta,17alpha)-17-ethynyl-17-hydroxy-7-methylestr-5(10)-en-3-one

Molecular Formula: C21H28O2Molecular Weight: 312.445820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: WZDGZWOAQTVYBX-XOINTXKNSA-N

• Timolol
IUPAC Name: (2S)-1-(tert-butylamino)-3-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]propan-2-ol | CAS Registry Number: 26839-75-8
Synonyms: timolol, Blocadren, Istalol, Timopic, Timoptic, Timoptol, Betimol, Optimol, Timacar, Timolol maleate, Timolol GFS, (S)-timolol, Timololum [INN-Latin], Timolol [USAN], S(-)-Timolol maleate, Tocris-0649, Prestwick0_000948, Prestwick1_000948, Prestwick2_000948, Prestwick3_000948

Molecular Formula: C13H24N4O3SMolecular Weight: 316.419660 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 7

InChIKey: BLJRIMJGRPQVNF-JTQLQIEISA-N

• Tizanidine
IUPAC Name: 6-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-2,1,3-benzothiadiazol-7-amine | CAS Registry Number: 51322-75-9
Synonyms: tizanidine, Sirdalud, Ternelin, Zanaflex, Tizanidinum [INN-Latin], Tizanidine hydrochloride, Tizanidina [INN-Spanish], Tizanidine [INN:BAN], C9H8ClN5S, CID5487, BB_SC-4087, BRN 0618691, DB00697, NCGC00160529-01, NCGC00160529-02, NCGC00160529-03, NCGC00160529-04, LS-40470, C07452, 2,1,3-Benzothiadiazole, 5-chloro-4-(2-imidazolin-2-ylamino)-

Molecular Formula: C9H8ClN5SMolecular Weight: 253.711320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: XFYDIVBRZNQMJC-UHFFFAOYSA-N

• Tocainide
IUPAC Name: 2-amino-N-(2,6-dimethylphenyl)propanamide | CAS Registry Number: 41708-72-9
Synonyms: tocainide, Tonocard, (S)-Tocainide, Alanyl-2,6-xylidide, Tocainidum [INN-Latin], Tocainida [INN-Spanish], Tocainide hydrochloride, Astra W 36095, Tocainide (USAN/INN), Prestwick0_001027, Prestwick1_001027, Prestwick2_001027, Prestwick3_001027, Tocainide [USAN:BAN:INN], BSPBio_001213, MLS000759525, MLS001423966, 2-Amino-2',6'-propionoxylidide, SPBio_003074, BPBio1_001335

Molecular Formula: C11H16N2OMolecular Weight: 192.257540 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: BUJAGSGYPOAWEI-UHFFFAOYSA-N

• Tolterodine
IUPAC Name: 2-[(1R)-3-[di(propan-2-yl)amino]-1-phenylpropyl]-4-methylphenol | CAS Registry Number: 124937-51-5
Synonyms: tolterodine, (+)-Tolterodine, MLS001195620, MLS001304745, CHEBI:9622, KS-1121, NCGC00159519-02, SMR000596518, LS-187278, (+)-(R)-2-(alpha-(2-(Diisopropylamino)ethyl)benzyl)-p-cresol, 2-[(1R)-3-(diisopropylamino)-1-phenylpropyl]-4-methylphenol, 2-{(1R)-3-[bis(1-methylethyl)amino]-1-phenylpropyl}-4-methylphenol

Molecular Formula: C22H31NOMolecular Weight: 325.487640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: OOGJQPCLVADCPB-HXUWFJFHSA-N

• Topiramate
Synonyms: topiramate, Topamax, Epitomax, Topamax Sprinkle, Topimax, Topina, Topiramic acid, Tipiramate [French], Tipiramato [Spanish], topiramatum [Latin], Topiramate (TPM), Topamax (TN), Topiramatum [INN-Latin], Topiramate / Placebo, Topiramato [INN-Spanish], McN-4853, Cilag brand of topiramate, Ortho brand of topiramate, Spectrum2_001128, McN 4853

Molecular Formula: C12H21NO8SMolecular Weight: 339.362040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 9

InChIKey: KJADKKWYZYXHBB-XBWDGYHZSA-N

• Torsemide
IUPAC Name: 1-[4-(3-methylanilino)pyridin-3-yl]sulfonyl-3-propan-2-ylurea | CAS Registry Number: 56211-40-6
Synonyms: Torasemide, Demadex, TORSEMIDE, Luprac, Presoril, Toradiur, Torocard, Dilutol, Sutril, Torrem, Torem, Unat, Torasemide N, Torsemide [USAN], Torsemide (USP), Demadex (TN), Luprac (TN), Torasemidum [INN-Latin], Torasemida [INN-Spanish], Ambap3994

Molecular Formula: C16H20N4O3SMolecular Weight: 348.420000 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: NGBFQHCMQULJNZ-UHFFFAOYSA-N

• Tramadol
IUPAC Name: (1R,2R)-2-(dimethylaminomethyl)-1-(3-methoxyphenyl)cyclohexan-1-ol | CAS Registry Number: 27203-92-5
Synonyms: Ultram, Ralivia flashtab, Tramal, Ralivia ER, Tramodol Hcl, Tramadol HCl, Tramadolum [INN-Latin], tramadol hydrochloride, Tramadol [INN:BAN], MLS000333190, C16H25NO2, EINECS 248-319-6, BB_SC-1254, CID33741, DB00193, NCGC00159343-02, LS-57115, LS-57116, SMR000436547, K-315

Molecular Formula: C16H25NO2Molecular Weight: 263.375200 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: TVYLLZQTGLZFBW-ZBFHGGJFSA-N

• Trandolapril
IUPAC Name: (2S,3aR,7aS)-1-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid | CAS Registry Number: 87679-37-6
Synonyms: trandolapril, Mavik, Gopten, Preran, Odric, Odrik, Tarka, Udrik, Trandolaprilum [Latin], Mavik (TN), Trandolapril (JAN/INN), Trandolapril [BAN:INN], Trandolapril [INN:BAN], CCRIS 6594, C24H34N2O5, RU 44570, RU-44570, DB00519, RU44570, LS-82763

Molecular Formula: C24H34N2O5Molecular Weight: 430.537160 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: VXFJYXUZANRPDJ-WTNASJBWSA-N

• Trimebutine
IUPAC Name: [2-(dimethylamino)-2-phenylbutyl] 3,4,5-trimethoxybenzoate | CAS Registry Number: 39133-31-8
Synonyms: trimebutine, Debridat, Trimebutine maleate, Trimebutinum [INN-Latin], Trimebutine maleate salt, Trimebutino [INN-Spanish], T6159_SIGMA, Trimebutine [BAN:DCF:INN], Trimebutine [INN:BAN:DCF], C22H29NO5, EINECS 254-309-2, CID5573, TM-906, ST075206, LS-174771, 2-Dimethylamino-2-phenylbutyl 3,4,5-trimethoxybenzoat, Benzoic acid, 3,4,5-trimethoxy-, 2-(dimethylamino)-2-phenylbutyl ester, 2-(dimethylamino)-2-phenylbutyl 3,4,5-tris(methyloxy)benzoate, 3,4,5-Trimethoxybenzoic acid 2-(dimethylamino)-2-phenylbutyl ester, beta-(Dimethylamino)-beta-ethylphenethyl alcohol 3,4,5-trimethoxybenzoate (ester)

Molecular Formula: C22H29NO5Molecular Weight: 387.469360 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: LORDFXWUHHSAQU-UHFFFAOYSA-N

• Trimegestone
IUPAC Name: (8S,13S,14S,17S)-17-[(2S)-2-hydroxypropanoyl]-13,17-dimethyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one | CAS Registry Number: 74513-62-5
Synonyms: Ondeva, Trimegestone [INN], 21-hydroxypromegestone, Totelle Sekvens, Ondeva, Trimegestone (USAN/INN), Ru-27987, trimegestone, (17beta(R))-isomer, RU 27987, RU 27988, RU-27988, D06235, C050319, 17beta-(S)-Lactoyl-17-methylestra-4,9-dien-3-one, 17-(2-hydroxy-1-oxopropyl)-17-methylestra-4,9-dien-3-one, Estra-4,9-dien-3-one, 17-(2-hydroxy-1-oxopropyl)-17-methyl-, (17beta(S))-

Molecular Formula: C22H30O3Molecular Weight: 342.471800 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: JUNDJWOLDSCTFK-MTZCLOFQSA-N

• Trospium Chloride
IUPAC Name: [(1R,5S)-spiro[8-azoniabicyclo[3.2.1]octane-8,1'-azolidin-1-ium]-3-yl] 2-hydroxy-2,2-diphenylacetate chloride | CAS Registry Number: 10405-02-4
Synonyms: trospium chloride, 3-((hydroxydiphenylacetyl)oxy)-spiro(8-azoniabicyclo(3.2.1)octane-8,1'-pyrrolidinium chloride

Molecular Formula: C25H30ClNO3Molecular Weight: 427.963600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: RVCSYOQWLPPAOA-DHWZJIOFSA-M

• Trovafloxacin
IUPAC Name: 7-[(1R,5S)-6-amino-3-azabicyclo[3.1.0]hexan-3-yl]-1-(2,4-difluorophenyl)-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid | CAS Registry Number: 147059-72-1
Synonyms: Trovan, Trovan (oral), TVFX, Fluorinated quinolone, Trovafloxacin [INN], Trovafloxacin mesylate, C20H15F3N4O3, AIDS010848, AIDS106741, AIDS-010848, AIDS-106741, CID62959, CP99219, DB00685, LS-95890, 147059-75-4 (MESYLATE), CP-99,219, 147059-72-1 (FREE BASE), 146836-84-2 (MESYLATE DELETED), CP-99219-27

Molecular Formula: C20H15F3N4O3Molecular Weight: 416.353310 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 10

InChIKey: WVPSKSLAZQPAKQ-SOSAQKQKSA-N

• Tyramine HCl
IUPAC Name: 4-(2-aminoethyl)phenol hydrochloride | CAS Registry Number: 60-19-5
Synonyms: tyramine, Tyramine HCL, Tyramine hydrochloride, Tyramine monochloride, Tyrosamine hydrochloride, p-Tryamine hydrochloride, p-Tyramine hydrochloride, CCRIS 986, 4-Hydroxyphenethylamine hydrochloride, 4-(2-Aminoethyl)phenol hydrochloride, T2879_SIGMA, 4-Hydroxyphenethylammonium chloride, 93820_FLUKA, EINECS 200-462-5, NSC 27430, CID66449, SBB003808, Phenol, p-(2-aminoethyl)-, monochloride, AI3-52151, Phenol, 4-(2-aminoethyl)-, hydrochloride

Molecular Formula: C8H12ClNOMolecular Weight: 173.639980 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 2

InChIKey: RNISDHSYKZAWOK-UHFFFAOYSA-N

• Ursodeoxycholic Acid
IUPAC Name: (4R)-4-[(3R,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid | CAS Registry Number: 128-13-2
Synonyms: ursodiol, Actigall, Delursan, Destolit, Litursol, Peptarom, Solutrat, Ursobilin, Ursochol, Ursodamor, Ursofalk, Ursolvan, Arsacol, Deursil, Ursacol, Lyeton, Cholit-ursan, URSODEOXYCHOLIC ACID, UrSO, Urso Forte

Molecular Formula: C24H40O4Molecular Weight: 392.572000 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: RUDATBOHQWOJDD-UZVSRGJWSA-N

• valacyclovir
IUPAC Name: 2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethyl (2S)-2-amino-3-methylbutanoate | CAS Registry Number: 124832-26-4
Synonyms: Valaciclovir, Valtrex, Acetylpromazine, Zelitrex, Talavir, Virval, Acyclovir-valine, Valaciclovir Hcl, ValACV, ACEPROMAZINE, VACV, Valaciclovir, Valtrex, Valacyclovir hydrochloride, Valacyclover Hydrochloric, Valaciclovir hydrochloride, Valacyclover Hydrochloride, Valaciclovir [INN:BAN], valacyclovir, (L)-isomer, BSPBio_002474, MLS001304747

Molecular Formula: C13H20N6O4Molecular Weight: 324.335700 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 9

InChIKey: HDOVUKNUBWVHOX-QMMMGPOBSA-N

• Valsartan
IUPAC Name: (2S)-3-methyl-2-[pentanoyl-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]amino]butanoic acid | CAS Registry Number: 137862-53-4
Synonyms: valsartan, Diovan, Exforge, Mixture Name, Diovan Hct, Diovan (TN), Valsartan [USAN:INN], Spectrum_001796, Spectrum2_001120, Spectrum3_001831, Spectrum4_000749, Spectrum5_001582, BSPBio_003501, KBioGR_001078, KBioSS_002289, MLS000759423, MLS001424088, Valsartan (JAN/USAN/INN), SPECTRUM1505209, SPBio_001260

Molecular Formula: C24H29N5O3Molecular Weight: 435.518760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 7

InChIKey: ACWBQPMHZXGDFX-QFIPXVFZSA-N

• Vancomycin
Synonyms: Vancocin, VANCOMYCIN, Vancomycin [USAN], Vancomycine [INN-French], Vancomycinum [INN-Latin], Vancomicina [INN-Spanish], Prestwick0_000497, Prestwick1_000497, Prestwick2_000497, Lopac0_001267, HSDB 3262, Vancomycin [USAN:INN:BAN], SPBio_002314, C66H75Cl2N9O24, CHEBI:28001, EINECS 215-772-6, AIDS070034, AIDS-070034, 1404-93-9 (MONOHYDROCHLORIDE), LS-161387

Molecular Formula: C66H75Cl2N9O24Molecular Weight: 1449.253600 [g/mol]
H-Bond Donor: 19H-Bond Acceptor: 26

InChIKey: MYPYJXKWCTUITO-LYRMYLQWSA-N

• Venlafaxine
IUPAC Name: 1-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]cyclohexan-1-ol | CAS Registry Number: 93413-69-5
Synonyms: venlafaxine, Elafax, VenlafaxineXR, Venlafaxine ER, Venlafaxine [INN:BAN], Venlafaxinum [INN-Latin], venlafaxine (Effexor), Venlafaxina [INN-Spanish], Spectrum_001671, SpecPlus_000842, Venlafaxine hydrochloride, Venlafaxine [BAN:INN], Spectrum2_000542, Spectrum3_000989, Spectrum4_001115, Spectrum5_001516, BSPBio_002657, KBioGR_001590, KBioSS_002151, DivK1c_006938

Molecular Formula: C17H27NO2Molecular Weight: 277.401780 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: PNVNVHUZROJLTJ-UHFFFAOYSA-N

• Vitamin B1
IUPAC Name: 2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol chloride | CAS Registry Number: 59-43-8
Synonyms: thiamin, thiamine, Vitaneurin, Aneurine, Betabion, Bethiamin, Oryzanin, Oryzanine, Beivon, Apatate drape, vitamin B1, Thiamine monochloride, Thiamine, chloride, B-Amin, Thiaminum [INN-Latin], Tiamina [INN-Spanish], Thiamine [INN:BAN], thiamine(1+) chloride, Thiamine monohydrochloride, CCRIS 5823

Molecular Formula: C12H17ClN4OSMolecular Weight: 300.807580 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: MYVIATVLJGTBFV-UHFFFAOYSA-M

• Vitamin B6
IUPAC Name: 4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol | CAS Registry Number: 65-23-6
Synonyms: pyridoxine, Pyridoxol, Gravidox, vitamin B6, Pyridoxolum, Pyridoxin, Adermine, Hydoxin, Aderoxine, Vitaped, pyridoxamine, Pyridoxine HCl, Infuvite Pediatric, Pyridoxine chloride, Cernevit-12, Piridossina [DCIT], Pyridoxin hydrochloride, Adermin hydrochloride, Pyridoxinium chloride, nchembio.93-comp1

Molecular Formula: C8H11NO3Molecular Weight: 169.177840 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: LXNHXLLTXMVWPM-UHFFFAOYSA-N

• Vitamin D 3
IUPAC Name: (1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol | CAS Registry Number: 67-97-0
Synonyms: cholecalciferol, Vitamin D3, Calciol, Colecalciferol, Ricketon, Trivitan, Vigorsan, Deparal, Colecalcipherol, Arachitol, Delsterol, Vigantol, Quintox, Rampage, Ebivit, Oleovitamin D3, Cholecalciferolum, D3-Vicotrat, D3-Vigantol, FeraCol

Molecular Formula: C27H44OMolecular Weight: 384.637660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: QYSXJUFSXHHAJI-YRZJJWOYSA-N

• Voriconazole
IUPAC Name: (2R,3S)-2-(2,4-difluorophenyl)-3-(5-fluoropyrimidin-4-yl)-1-(1,2,4-triazol-1-yl)butan-2-ol | CAS Registry Number: 137234-62-9
Synonyms: Vfend, Vfend (TN), Pfizer brand of voriconazole, MLS000759464, MLS001424082, Voriconazole (JAN/USAN/INN), Voriconazole [USAN:BAN:INN], Voriconazole [USAN:INN:BAN], DRG-0301, AIDS045515, AIDS-045515, UK-109496, UK-109,496, DB00582, CPD000466350, SAM001246664, SMR000466350, LS-181799, TL8000858, UK 109496

Molecular Formula: C16H14F3N5OMolecular Weight: 349.310470 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 9

InChIKey: BCEHBSKCWLPMDN-MGPLVRAMSA-N

• Xylometazoline
IUPAC Name: 2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole | CAS Registry Number: 526-36-3
Synonyms: xylometazoline, Xylomethazoline, Otrivine, Otriven, Otrivin, Otrix, Novorin, Spectrum_000382, Prestwick0_000223, Prestwick1_000223, Prestwick2_000223, Prestwick3_000223, Spectrum2_000945, Spectrum3_000586, Spectrum4_000382, Spectrum5_001469, Lopac-X-6000, Xylometazolinum [INN-Latin], Xilometazolina [INN-Spanish], Xylometazoline hydrochloride

Molecular Formula: C16H24N2Molecular Weight: 244.375160 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: HUCJFAOMUPXHDK-UHFFFAOYSA-N

• Zafirlukast
IUPAC Name: cyclopentyl N-[3-[[2-methoxy-4-[(2-methylphenyl)sulfonylcarbamoyl]phenyl]methyl]-1-methylindol-5-yl]carbamate | CAS Registry Number: 107753-78-6
Synonyms: zafirlukast, Accolate, Olmoran, Accoleit, Aeronix, Zafirst, Respix, Accolate (TN), Zeneca brand of zafirkulast, Zafirlukast [USAN:BAN:INN], Menarini brand of zafirlukast, Novartis brand of zafirlukast, MLS000759421, MLS001424064, Zafirlukast (JAN/USAN/INN), AstraZeneca brand of zafirlukast, ICI-204219, STOCK6S-45610, C31H33N3O6S, CHEBI:10100

Molecular Formula: C31H33N3O6SMolecular Weight: 575.675220 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 7

InChIKey: YEEZWCHGZNKEEK-UHFFFAOYSA-N

• Zaleplon
IUPAC Name: N-[3-(3-cyanopyrazolo[1,5-a]pyrimidin-7-yl)phenyl]-N-ethylacetamide | CAS Registry Number: 151319-34-5
Synonyms: zaleplon, Sonata, Zerene, Sonata (TN), Zaleplon [USAN:INN], DEA No. 2781, Zaleplon (JAN/USAN/INN), MLS000759451, ZAL 846, C17H15N5O, LJC 10846, BB_SC-4140, SKP-1041, AZ-007, LJC-10846, L846, CL-284846, DB00962, LS-8737, CL 284,846

Molecular Formula: C17H15N5OMolecular Weight: 305.333900 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: HUNXMJYCHXQEGX-UHFFFAOYSA-N

• Zidovudine
IUPAC Name: 1-[(2R,4S,5S)-4-azido-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione | CAS Registry Number: 30516-87-1
Synonyms: zidovudine, Azidothymidine, Retrovir, Combivir, Trizivir, antiviral, Compound S, Aztec, Mixture Name, 3'-Azido-3'-deoxythymidine, AZT Antiviral, Propolis+AZT, azidodeoxythymidine, AZT, Antiviral, Zidovudinum [Latin], 3'-Azidothymidine, AZT (Antiviral), Zidovudina [Spanish], Retrovir (TN), Cpd S

Molecular Formula: C10H13N5O4Molecular Weight: 267.241320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: HBOMLICNUCNMMY-XLPZGREQSA-N

• Zileuton
IUPAC Name: 1-[1-(1-benzothiophen-2-yl)ethyl]-1-hydroxyurea | CAS Registry Number: 111406-87-2
Synonyms: ZILEUTON, Zyflo, Leutrol, Zyflo Filmtab, Zyflo CR, Zyflo (TN), Zileutonum [INN-Latin], Abbott 64077, Abbot 64077, Ambap5426, Zileuton (USP/INN), Abbott brand of zileuton, Prestwick0_001090, Zileuton [USAN:BAN:INN], Zileuton [USAN:INN:BAN], MLS000759510, MLS001424079, CTI-02, C11H12N2O2S, CHEBI:10112

Molecular Formula: C11H12N2O2SMolecular Weight: 236.290180 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: MWLSOWXNZPKENC-UHFFFAOYSA-N

• Ziprasidone
IUPAC Name: 5-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-6-chloro-1,3-dihydroindol-2-one | CAS Registry Number: 146939-27-7
Synonyms: Zeldox, ziprazidone, Geodon, Ambap6301, Ziprasidone hydrochloride, Ziprasidone [INN:BAN], C21H21ClN4OS, MLS000759435, Ziprasidone mesylate trihydrate, CHEBI:10119, CID60854, DB00246, CP 88059, CPD000466328, LS-83744, SAM001246607, SMR000466328, CP-88,059, TL8000889, CP 88059-01

Molecular Formula: C21H21ClN4OSMolecular Weight: 412.935640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: MVWVFYHBGMAFLY-UHFFFAOYSA-N

• Zoledronic Acid
IUPAC Name: (1-hydroxy-2-imidazol-1-yl-1-phosphonoethyl)phosphonic acid | CAS Registry Number: 118072-93-8
Synonyms: Zoledronic acid, Zoledronate, Zometa, Aclasta, Reclast, Bisphosphonate 3, Zometa (Novartis), Zoledronic acid [USAN:INN], STOCK1N-71622, CHEBI:46557, Novartis brand of zoledronic acid, CGP 42446, CGP 42446A, CID68740, CGP-42446, NSC721517, (1-Hydroxy-2-imidazol-1-ylethylidene)diphosphonic acid, CGP 42'446, CGP-42'446, DB00399

Molecular Formula: C5H10N2O7P2Molecular Weight: 272.089622 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 9

InChIKey: XRASPMIURGNCCH-UHFFFAOYSA-N

• Zolmitriptan
IUPAC Name: (4S)-4-[[3-(2-dimethylaminoethyl)-1H-indol-5-yl]methyl]-1,3-oxazolidin-2-one | CAS Registry Number: 139264-17-8
Synonyms: zolmitriptan, Zomig, Zomigon, Flezol, AscoTop, Zomig Nasal Spray, Zomig ZMT, Zomig-ZMT, Zolmitriptan [USAN], Spectrum2_000728, MLS000758208, MLS001424172, SPECTRUM1505281, SPBio_000656, CHEBI:10124, C16H21N3O2, CID60857, 311C90, BW-311C90, CPD000449310

Molecular Formula: C16H21N3O2Molecular Weight: 287.356840 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: ULSDMUVEXKOYBU-ZDUSSCGKSA-N

• Zolpidem
IUPAC Name: N,N-dimethyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide | CAS Registry Number: 82626-48-0
Synonyms: zolpidem, Lorex, Ambien, Zolpidemum [Latin], ZOLPIDEM TARTRATE, Zolpidem [INN:BAN], Z103_SIGMA, DEA No. 2783, BSPBio_002278, SPECTRUM1505369, STOCK6S-53875, CID5732, 2C19H21N3O, DB00425, SL-800750, NCGC00095179-01, NCGC00095179-02, NCGC00095179-03, NCGC00095179-04, LS-80196

Molecular Formula: C19H21N3OMolecular Weight: 307.389540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: ZAFYATHCZYHLPB-UHFFFAOYSA-N

• Zonisamide
IUPAC Name: 1,2-benzoxazol-3-ylmethanesulfonamide | CAS Registry Number: 68291-97-4
Synonyms: zonisamide, Zonegran, Exceglan, Excegram, Excegran, Tremode, Trerief, Zonisamidum [Latin], Zonisamida [Spanish], Excegran (TN), Zonisamide (ZNS), C8H8N2O3S, HSDB 7293, MLS001195632, MLS001306491, Zonisamide (JAN/USAN/INN), AD-810, CI-912, Zonisamide [USAN:BAN:INN:JAN], 1,2-Benzisoxazole-3-methanesulfonamide

Molecular Formula: C8H8N2O3SMolecular Weight: 212.225720 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: UBQNRHZMVUUOMG-UHFFFAOYSA-N

• 17a-HydroxyProgesterone
IUPAC Name: (8R,9S,10R,13S,14S,17R)-17-acetyl-17-hydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one | CAS Registry Number: 68-96-2
Synonyms: Prodix, Prodox, Gestageno gador, hydroxyprogesterone, Proluton, Setaderm, Oxiprogesteronum, 17-Hydroxyprogesterone, Gestageno, Idrossiprogesterone [DCIT], 17 Hydroxyprogesterone, 17ALPHA-HYDROXYPROGESTERONE, 17-alpha-Hydroxyprogesterone, 17alpha-Hydroxy-progesterone, HSDB 3343, Hydroxyprogesteronum [INN-Latin], Hidroxiprogesterona [INN-Spanish], 17 alpha Hydroxyprogesterone, 17 alpha-Hydroxyprogesterone, 17-Hydroxypregn-4-ene-3,20-dione

Molecular Formula: C21H30O3Molecular Weight: 330.461100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DBPWSSGDRRHUNT-CEGNMAFCSA-N

• 2'-Deoxy-5-FluoroUridine (FUDR)
IUPAC Name: 5-fluoro-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione | CAS Registry Number: 50-91-9
Synonyms: floxuridine, Floxuridin, Fluorodeoxyuridine, FdUrd, Deoxyfluorouridine, FUDR, 5-Fluorodeoxyuridine, 5 Fluorodeoxyuridine, 2'-Deoxy-5-fluorouridine, 5-FdUrd, Fluoruridine deoxyribose, 5-Fluoro-dUrd, 5FdU, FDUR, Floxuridinum [INN-Latin], 5-Fluoro-2'-deoxyuridine, Floxiridina [INN-Spanish], 5-Fluoro-2-desoxyuridine, Floxuridine [USAN:INN], 5-FUDR

Molecular Formula: C9H11FN2O5Molecular Weight: 246.192443 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 6

InChIKey: ODKNJVUHOIMIIZ-RRKCRQDMSA-N

• 6a-MethylPrednisolone
IUPAC Name: (6S,8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-6,10,13-trimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-one | CAS Registry Number: 83-43-2
Synonyms: methylprednisolone, Medrol, Medrone, Metilbetasone, Promacortine, Dopomedrol, Metrisone, Medesone, Mesopren, Metastab, Noretona, Urbasone, Besonia, Medrate, Moderin, Urbason, Wyacort, Sieropresol, Suprametil, Esametone

Molecular Formula: C22H30O5Molecular Weight: 374.470600 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: VHRSUDSXCMQTMA-PJHHCJLFSA-N

• 2'-Deoxythymidine
IUPAC Name: 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione | CAS Registry Number: 50-89-5
Synonyms: thymidine, deoxythymidine, Thymidin, DThyd, dThd, Thyminedeoxyriboside, 5-Methyldeoxyuridine, 5-Methyldeoxyurindine, Deoxyribothymidine, Thymine-2-desoxyriboside, 2'-thymidine, Thymine deoxyriboside, Tritiated thymidine, (3H)Thymidine, Thymine-2-deoxyriboside, 5-Methyl-2'-deoxyuridine, Thymidine-(H-3), nchembio.90-comp10, 1w2g, Thymine 2-desoxyriboside

Molecular Formula: C10H14N2O5Molecular Weight: 242.228560 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: IQFYYKKMVGJFEH-XLPZGREQSA-N

• (+)-6-Methoxy-Alpha-Methyl-2-Naphthaleneacetic Acid
IUPAC Name: (2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid | CAS Registry Number: 22204-53-1
Synonyms: NAPROXEN, Equiproxen, Laraflex, Calosen, Reuxen, Bonyl, Axer, d-Naproxen, Novonaprox, Rheumaflex, Saritilron, Acusprain, Anexopen, Arthrisil, Artrixen, Artroxen, Bipronyl, Clinosyn, Danaprox, Flexipen

Molecular Formula: C14H14O3Molecular Weight: 230.259160 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: CMWTZPSULFXXJA-VIFPVBQESA-N

• 1-Hydroxyethylidene-1,1-Diphosphonic Acid (Hedp)
IUPAC Name: (1-hydroxy-1-phosphonoethyl)phosphonic acid | CAS Registry Number: 2809-21-4
Synonyms: Etidronic acid, Etidronsaeure, Turpinal SL, etidronate, EHDP, HEDP, Diphosphonate (base), Acetodiphosphonic acid, Dequest Z 010, Dequest 2010, Dequest 2015, Ferrofos 510, Etidronate disodium, Hydroxyethanediphosphonic acid, Oxyethylidenediphosphonic acid, Prestwick0_000863, Prestwick1_000863, Prestwick2_000863, Prestwick3_000863, 1-Hydroxyethanediphosphonic acid

Molecular Formula: C2H8O7P2Molecular Weight: 206.028242 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 7

InChIKey: DBVJJBKOTRCVKF-UHFFFAOYSA-N

• 3-Pyridine Carboxamide
IUPAC Name: pyridine-3-carboxamide | CAS Registry Number: 98-92-0
Synonyms: nicotinamide, niacinamide, vitamin PP, 3-Pyridinecarboxamide, Aminicotin, Amixicotyn, Papulex, Nikotinamid, Savacotyl, Endobion, Hansamid, Nicobion, vitamin B3, Benicot, Dipegyl, Pelmine, Delonin amide, Pelonin amide, Nicotililamido, Nicosylamide

Molecular Formula: C6H6N2OMolecular Weight: 122.124640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: DFPAKSUCGFBDDF-UHFFFAOYSA-N

• 4,4-Diamino Diphenyl Sulphone
IUPAC Name: 4-(4-aminophenyl)sulfonylaniline | CAS Registry Number: 80-08-0
Synonyms: dapsone, Diaphenylsulfone, Disulone, Dapson, Diaphenylsulfon, Avlosulfone, Diphenasone, Sulfadione, Sulfona, Aczone, Udolac, Metabolite C, Sulfonyldianiline, Croysulfone, Sulphadione, Acedapsone, Avlosulfon, Novophone, Dapsonum, Dumitone

Molecular Formula: C12H12N2O2SMolecular Weight: 248.300880 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: MQJKPEGWNLWLTK-UHFFFAOYSA-N

• 4-Pyridine Carboxylic Acid
IUPAC Name: pyridine-4-carboxylic acid | CAS Registry Number: 55-22-1
Synonyms: ISONICOTINIC ACID, 4-Carboxypyridine, 4-Picolinic acid, 4-Pyridinecarboxylic acid, gamma-Picolinic acid, isonicotonic acid, p-Pyridinecarboxylic acid, Pyridine-4-carboxylic acid, gamma-Pyridinecarboxylic acid, .gamma.-Picolinic acid, 1,4-Dihydroisonicotinic acid, Biomol-NT_000289, Acide iso-nicotinique [French], Oprea1_749724, I17508_ALDRICH, BPBio1_001365, CHEBI:6032, NSC 1483, 58930_FLUKA, EINECS 200-228-2

Molecular Formula: C6H5NO2Molecular Weight: 123.109400 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: TWBYWOBDOCUKOW-UHFFFAOYSA-N

• 5-Aminosalicylic Acid
IUPAC Name: 5-amino-2-hydroxybenzoic acid | CAS Registry Number: 89-57-6
Synonyms: mesalamine, Mesalazine, Pentasa, 5-Aminosalicylic acid, Asacol, Rowasa, Claversal, Salofalk, Canasa, Lialda, Mesalazina, Mesalazinum, Mesavance, Mezavant, m-Aminosalicylic acid, Mesasal, Apriso, Iialda, 5-Aminosalicylate, Mesalazine MMX

Molecular Formula: C7H7NO3Molecular Weight: 153.135380 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: KBOPZPXVLCULAV-UHFFFAOYSA-N


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