APAC Pharmaceutical, LLC

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Contact: Andy Yao
Web: http://www.apacpharma.com
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Address: 6851 Oak Hall Lane, Suite 101, Columbia, Maryland 21045, USA
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Profile: APAC Pharmaceutical, LLC is a custom chemical and cGMP manufacturing company. We provide chemistry & manufacturing solutions for specialty chemical, pharmaceutical and bio-tech companies. Our specialty product lines are specialty intermediates, metabolites, research reference standards, and drug like compound libraries. These products represent highly characterized compounds of drug substances, impurities, degradation products, metabolites and performance calibrators. Our products include fondaparinux sodium, 2,3,0-(3-pentylidene)-d-gluceraldhyde, 4, 4 -difluoro-cyclohexane carboxylic acid, 1,3,5-tris[(3,3,3-trifluoropropyl)methyl]cyclotrisiloxane, (s)-(-)-4-benzyl-2-oxazolidinone, d-(-)-2-aminobutylic acid, and (r)-tert-butanesulfinamide. We are also specialized in the research and production of synthetic peptides. We develop and manufacture custom peptides & custom cGMP peptides. We have a wide range of modified peptides such as those with unnatural amino acid, phosphorylation, terminal modifications and cyclization. We specialize in the modification of nucleosides and nucleotides. We offer a variety of modified and non-modified nucleoside/nucleotide as well as their analogs. We manufacture a variety of aromatic and unsaturated N, O, S heterocyclic ring including heteroaromatic synthons, complex heterocyclic systems & novel heteroaromatic compounds.

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• Fenofibrate

IUPAC Name: propan-2-yl 2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoate | CAS Registry Number: 49562-28-9
Synonyms: fenofibrate, Lipantil, Tricor, Procetofen, Lipanthyl, Triglide, Lipidil, Secalip, Antara, Finofibrate, Proctofene, Lipoclar, Fenogal, Lipirex, Sedufen, Phenofibrate, Elasterate, Procetofene, Protolipan, Elasterin

Molecular Formula:	C₂₀H₂₁ClO₄	Molecular Weight:	360.831340 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: YMTINGFKWWXKFG-UHFFFAOYSA-N

• Ferulic Acid

IUPAC Name: (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid | CAS Registry Number: 1135-24-6
Synonyms: ferulic acid, ferulate, (E)-Ferulic acid, Ferulic acid, trans-, 4-Hydroxy-3-methoxycinnamic acid, Spectrum5_000554, ferulic acid, (E)-isomer, BSPBio_003168, FERULIC ACID (TRANS), MLS001066385, MLS001332483, MLS001332484, SPECTRUM1501017, W518301_ALDRICH, 128708_ALDRICH, CCRIS 7575, Cinnamic acid, 4-hydroxy-3-methoxy-, 46278_FLUKA, CHEBI:17620, EINECS 208-679-7

Molecular Formula:	C₁₀H₁₀O₄	Molecular Weight:	194.184000 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: KSEBMYQBYZTDHS-HWKANZROSA-N

• Floxuridine

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:	C₉H₁₁FN₂O₅	Molecular Weight:	246.192443 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	6

InChIKey: ODKNJVUHOIMIIZ-RRKCRQDMSA-N

• Flubendazole

IUPAC Name: methyl N-[6-(4-fluorobenzoyl)-1H-benzimidazol-2-yl]carbamate | CAS Registry Number: 31430-15-6
Synonyms: Fluvermal, Flubenol, Flumoxal, Flumoxane, fluoromebendazole, Flubendazol, Flumoxanal, Flicum, Ambap6379, Flubendazol [INN-Spanish], Flubendazolum [INN-Latin], Flubendazole (USAN/INN), CCRIS 4480, Flubendazole [USAN:BAN:INN], MLS000759477, MLS001424042, 34091_RIEDEL, C16H12FN3O3, EINECS 250-624-4, NSC313680

Molecular Formula:	C₁₆H₁₂FN₃O₃	Molecular Weight:	313.283183 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	6

InChIKey: CPEUVMUXAHMANV-UHFFFAOYSA-N

• Fluconazole

IUPAC Name: 2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol | CAS Registry Number: 86386-73-4
Synonyms: fluconazole, Triflucan, Diflucan, Biozolene, Elazor, Biocanol, Fungata, Zonal, Alflucoz, Flucazol, Flukezol, Flunizol, Oxifugol, Pritenzol, Afungil, Cryptal, Dimycon, Fluzone, Canzol, Forcan

Molecular Formula:	C₁₃H₁₂F₂N₆O	Molecular Weight:	306.270786 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	9

InChIKey: RFHAOTPXVQNOHP-UHFFFAOYSA-N

• Flucytosine

IUPAC Name: 6-amino-5-fluoro-1H-pyrimidin-2-one | CAS Registry Number: 2022-85-7
Synonyms: flucytosine, 5-Fluorocytosine, Fluocytosine, Flucytosin, Ancobon, Fluorcytosine, Ancotil, 5-Fluorocytosin, 5-Fluorocystosine, Alcobon, Fluorocytosine, Flucytosone, Ancotyl, Cytosine, 5-fluoro-, 5-Flurocytosine, 5-FC, Ancobon (TN), Flucitosina [DCIT], Flucytosinum [INN-Latin], 5-Fluorocytosine-6-3H

Molecular Formula:	C₄H₄FN₃O	Molecular Weight:	129.092463 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: XRECTZIEBJDKEO-UHFFFAOYSA-N

• Flumetralin

IUPAC Name: N-[(2-chloro-6-fluorophenyl)methyl]-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline | CAS Registry Number: 62924-70-3
Synonyms: Flumetraline, Premier, FLUMETRALIN, Prime+, Flumetralin [BSI:ISO], Flumetraline [ISO-French], PS1211_SUPELCO, CGA-41065, 45501_RIEDEL, EPA Pesticide Chemical Code 123001, CID62210, BRN 2956801, NCGC00163864-01, NCGC00163864-02, LS-30420, Benzenemethanamine, 2-chloro-N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-ethyl-6-fluoro-, N-Ethyl-N-(2-chloro-6-fluorobenzyl)-4-trifluoromethyl-2,6-dinitroaniline, 2-Chloro-N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-ethyl-6-fluorobenzenemethanamine, N-(2-Chloro-6-fluorobenzyl)-N-ethyl-alpha,alpha,alpha-trifluoro-2,6-dinitro-p-toluidine, N-(2-Chloro-6-fluorobenzyl)-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline

Molecular Formula:	C₁₆H₁₂ClF₄N₃O₄	Molecular Weight:	421.730793 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	9

InChIKey: PWNAWOCHVWERAR-UHFFFAOYSA-N

• Folic acid

IUPAC Name: (2S)-2-[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid | CAS Registry Number: 59-30-3
Synonyms: folic acid, Folate, Vitamin Bc, Vitamin M, PteGlu, Folicet, Folvite, Folcysteine, Incafolic, Pteroylglutamic acid, Acifolic, Folcidin, Folettes, Foliamin, Folsaure, Millafol, Mittafol, Cytofol, Folacid, Folacin

Molecular Formula:	C₁₉H₁₉N₇O₆	Molecular Weight:	441.397460 [g/mol]
H-Bond Donor:	6	H-Bond Acceptor:	11

InChIKey: OVBPIULPVIDEAO-LBPRGKRZSA-N

• Folinic acid calcium

IUPAC Name: calcium (2S)-2-[[4-[(2-amino-5-formyl-4-oxo-1,6,7,8-tetrahydropteridin-6-yl)methylamino]benzoyl]amino]pentanedioate | CAS Registry Number: 1492-18-8
Synonyms: Wellcovorin, calcium folinate, Lederfoline, Calcium leucovorin, Uzel, LEUCOVORIN CALCIUM, Folinate-SF Calcium, Wellcovorin (TN), Prestwick_224, Folinic acid calcium salt, Leucovorin calcium salt, Calcium citrovorum factor, Uzel (TN), Leucovorin Calcium [USAN], Calcii folinas [INN-Latin], Leucovorin calcium (USP), Calcium folinate (JP15), Folinic acid-SF, calcium salt, Calcium 5-formyltetrahydrofolate, Folinato calcico [INN-Spanish]

Molecular Formula:	C₂₀H₂₁CaN₇O₇	Molecular Weight:	511.501440 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	11

InChIKey: KVUAALJSMIVURS-ZEDZUCNESA-L

• Fondaparinux sodium

IUPAC Name: decasodium (2R,3S,4S,5R,6R)-3-[(2R,3R,4R,5R,6R)-5-[(2R,3R,4R,5S,6S)-6-carboxylato-5-[(2R,3R,4R,5S,6R)-4,5-dihydroxy-3-(sulfonatoamino)-6-(sulfonatooxymethyl)oxan-2-yl]oxy-3,4-dihydroxyoxan-2-yl]oxy-3-(sulfonatoamino)-4-sulfonatooxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-4-hydroxy-6-[(2R,3S,4R,5R,6S)-4-hydroxy-6-methoxy-5-(sulfonatoamino)-2-(sulfonatooxymethyl)oxan-3-yl]oxy-5-sulfonatooxyoxane-2-carboxylate | CAS Registry Number: 114870-03-0
Synonyms: Arixtra, Quixidar, Fondaparin sodium, Arixtra (TN), Org-31540, CID636380, SR-90107A, Fondaparinux sodium (JAN/USAN/INN), DB00569, SR-90107, D01844, decasodium (2R,3S,4S,5R,6R)-3-[(2R,3R,4R,5R,6R)-5-[(2R,3R,4R,5S,6S)-6-carboxylato-5-[(2R,3R,4R,5S,6R)-4,5-dihydroxy-3-(sulfonatoamino)-6-(sulfonatooxymethyl)oxan-2-yl]oxy-3,4-dihydroxyoxan-2-yl]oxy-3-(sulfonatoamino)-4-sulfonatooxy-6-(sulfonatooxymethyl)oxan-2-yl]oxy-4-hydroxy-6-[(2R,3S,4R,5R,6S)-4-hydroxy-6-methoxy-5-(sulfonatoamino)-2-(sulfonatooxymethyl)oxan-3-yl]oxy-5-sulfonatooxyoxane-2-carboxylate

Molecular Formula:	C₃₁H₄₃N₃Na₁₀O₄₉S₈	Molecular Weight:	1728.081520 [g/mol]
H-Bond Donor:	9	H-Bond Acceptor:	52

InChIKey: XEKSTYNIJLDDAZ-JASSWCPGSA-D

• Forchlorfenuron

IUPAC Name: 1-(2-chloropyridin-4-yl)-3-phenylurea | CAS Registry Number: 68157-60-8
Synonyms: CPPU, Forchlorfenuron [ISO], 4PU30 cpd, 4-CPPU, C2791_SIGMA, N-(2-Chloro-4-pyridyl)-N'-phenylurea, CID93379, CPD-5481, 1-(2-chloropyridin-4-yl)-3-phenylurea, NCGC00164383-01, NCGC00164383-02, N-(2-Chloro-4-pyridinyl)-N'-phenylurea, Urea, N-(2-chloro-4-pyridinyl)-N'-phenyl-, LS-159608

Molecular Formula:	C₁₂H₁₀ClN₃O	Molecular Weight:	247.680300 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: GPXLRLUVLMHHIK-UHFFFAOYSA-N

• Frusemide

IUPAC Name: 4-chloro-2-(furan-2-ylmethylamino)-5-sulfamoylbenzoic acid | CAS Registry Number: 54-31-9
Synonyms: furosemide, Lasix, Furanthril, Furosemid, Fursemide, Errolon, Fusid, Fuluvamide, Furanthryl, Macasirool, Furantril, Lowpstron, Aisemide, Beronald, Desdemin, Frusemid, Frusemin, Fursemid, Prefemin, Rosemide

Molecular Formula:	C₁₂H₁₁ClN₂O₅S	Molecular Weight:	330.744140 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	7

InChIKey: ZZUFCTLCJUWOSV-UHFFFAOYSA-N

• g-Oryzanol

Synonyms: Oryzanol

Molecular Formula:	C₄₁H₆₀O₄	Molecular Weight:	616.912700 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: ZIWPYEIAPMTNTE-WRABICDASA-N

• Gabapentin

IUPAC Name: 2-[1-(aminomethyl)cyclohexyl]acetic acid | CAS Registry Number: 60142-96-3
Synonyms: gabapentin, Neurontin, Gabapetin, Gabapentine, Aclonium, Gabapentin GR, Gabapen, Novo-Gabapentin, Apo-Gabapentin, Gabapentin Hexal, Gabapentin Stada, PMS-Gabapentin, Gabapentino [Spanish], Neurontin (TN), Prestwick_151, Gabapentin-ratiopharm, Gabapentine [INN-French], Gabapentinum [INN-Latin], Gabapentino [INN-Spanish], gabapentin (Neurontin)

Molecular Formula:	C₉H₁₇NO₂	Molecular Weight:	171.236780 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: UGJMXCAKCUNAIE-UHFFFAOYSA-N

• Galanthamine hydrobromide

Synonyms: Razadyne, Nivalin, Reminyl, galanthamine, Nivaline, Galantamine hydrobromide, anti-Alzheimer, Jilkon hydrobromide, Reminyl XL, Razadyne (TN), Lycoremine hydrobromide, Prestwick_236, Nivaline (pharmaceutical), Galantamine hydrobromide, Galanthamine hydrogen bromide, Nivaline (C17 pharmaceutical), MLS000758283, MLS001401401, G1660_SIGMA, SPECTRUM1501202

Molecular Formula:	C₁₇H₂₂BrNO₃	Molecular Weight:	368.265480 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: QORVDGQLPPAFRS-XPSHAMGMSA-N

• Gallic acid

IUPAC Name: 3,4,5-trihydroxybenzoic acid | CAS Registry Number: 149-91-7
Synonyms: gallate, 3,4,5-Trihydroxybenzoic acid, Gallic acid, tech., Acid, Gallic, Gallic acid, tech, Gallic acid polymer, GALOP, Pyrogallol-5-carboxylic acid, 3,4,5-Trihydroxybenzoate, Benzoic acid, 3,4,5-trihydroxy-, Gallic acid monohydrate, Kyselina gallova [Czech], Spectrum_000342, SpecPlus_000307, Spectrum2_000399, Spectrum3_000254, Spectrum4_001544, Spectrum5_000108, CCRIS 5523, HSDB 2117

Molecular Formula:	C₇H₆O₅	Molecular Weight:	170.119540 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	5

InChIKey: LNTHITQWFMADLM-UHFFFAOYSA-N

• Gamma-Crotonolactone

IUPAC Name: 2H-furan-5-one | CAS Registry Number: 497-23-4
Synonyms: 2-Butenolide, Isocrotonolactone, 2(5H)-Furanone, Crotonolactone, 2-Buten-4-olide, BUTENOLIDE, gamma-Crotolactone, gamma-Crotonolactone, Furan-2(5H)-one, .gamma.-Crotonolactone, alpha,beta-Crotonolactone, 5H-furan-2-one, 2-Oxo-2,5-dihydrofuran, but-2-en-4-olide, 2-(5H)-furanone, 2-Buten-1,4-olide, delta,alpha,beta-Butenolide, 4-Hydroxy-2-butenoic acid lactone, 2-Butenoic acid gamma-lactone, 2-Butenoic acid-gamma-lactone

Molecular Formula:	C₄H₄O₂	Molecular Weight:	84.073360 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: VIHAEDVKXSOUAT-UHFFFAOYSA-N

• Gemfibrozil

IUPAC Name: 5-(2,5-dimethylphenoxy)-2,2-dimethylpentanoic acid | CAS Registry Number: 25812-30-0
Synonyms: gemfibrozil, Lopid, Lipur, Decrelip, Trialmin, Bolutol, Lipazil, Litarek, Ausgem, Pilder, Jezil, Apo-Gemfibrozil, Gemfibromax, Gemfibrosil, Renabrazin, Cholespid, Fibratol, Fibrocit, Gemfibril, Gemlipid

Molecular Formula:	C₁₅H₂₂O₃	Molecular Weight:	250.333380 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: HEMJJKBWTPKOJG-UHFFFAOYSA-N

• Genistein

IUPAC Name: 5,7-dihydroxy-3-(4-hydroxyphenyl)chromen-4-one | CAS Registry Number: 446-72-0
Synonyms: genistein, Genisteol, Genisterin, Prunetol, Sophoricol, Genestein, Differenol A, Isoflavone, Bonistein, 4',5,7-Trihydroxyisoflavone, 5,7,4'-Trihydroxyisoflavone, Lactoferrin-genistein, nchembio.76-comp6, Spectrum_000320, Tocris-1110, 1x7r, SpecPlus_000305, Spectrum2_000638, Spectrum3_000678, Spectrum4_001543

Molecular Formula:	C₁₅H₁₀O₅	Molecular Weight:	270.236900 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	5

InChIKey: TZBJGXHYKVUXJN-UHFFFAOYSA-N

• Glycyrrhizic acid

IUPAC Name: (2S,3S,4S,5R,6S)-6-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-5-[(2R,3R,4S,5S,6S)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylic acid | CAS Registry Number: 1405-86-3
Synonyms: glycyrrhizin, Glycyrrhizinic acid, Glycyrrizin, Glycyron, Liquorice, Glycyrrhizinate, Glycyram, Zinc Glycyrrhizate, Glycyrrhizin [JAN], Glycyrrhizin (JAN), Glycyrrhetinic acid glycoside, Ambap5075, 18-beta-Glycyrrhizic acid, Dipotassium glycyrrhizinate, Rizinsan K2 A2 (free acid), HSDB 496, AMMONIUM GLYCYRRHIZINATE, NSC 2800, CHEBI:15939, EINECS 215-785-7

Molecular Formula:	C₄₂H₆₂O₁₆	Molecular Weight:	822.932080 [g/mol]
H-Bond Donor:	8	H-Bond Acceptor:	16

InChIKey: LPLVUJXQOOQHMX-QWBHMCJMSA-N

• Goldamide

IUPAC Name: N-(5-amino-9,10-dioxoanthracen-1-yl)benzamide | CAS Registry Number: 117-06-6
Synonyms: 1-Amino-5-benzamidoanthraquinone, 1-Benzamido-5-aminoanthraquinone, 5-Benzamido-1-aminoanthraquinone, 1-Amino-5-benzoylaminoanthraquinone, Anthraquinone, 1-amino-5-benzamido-, NSC13981, EINECS 204-169-3, NSC 13981, ZINC03880275, Benzamide, N-(5-amino-1-anthraquinonyl)-, Benzamide, N-(5-amino-1-anthraquinonyl)- (8CI), Benzamide, N-(5-amino-9,10-dihydro-9,10-dioxo-1-anthracenyl)-, N-(5-Amino-9,10-dihydro-9,10-dioxo-1-anthryl)benzamide

Molecular Formula:	C₂₁H₁₄N₂O₃	Molecular Weight:	342.347460 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: FWEQPMZEKHHFTB-UHFFFAOYSA-N

• Guanosine

IUPAC Name: 2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one | CAS Registry Number: 118-00-3
Synonyms: guanosine, vernine, guanine riboside, Guanozin, Guanosin, nucleoside Q, Vernine (VAN), 1odj, 2fqx, Inosine, 2-amino-, Inosine, 2-amino, nchembio.136-comp1, USAF CB-11, 9-beta-D-Ribofuranosylguanine, Inosine, 2-amino- (VAN), beta-D-Ribofuranoside, guanine-9, Guanine, 9-beta-D-ribofuranosyl-, Ribofuranoside, guanine-9, beta-D-, nchembio.2007.33-comp42, SGCUT00093

Molecular Formula:	C₁₀H₁₃N₅O₅	Molecular Weight:	283.240720 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	9

InChIKey: NYHBQMYGNKIUIF-UUOKFMHZSA-N

• H-D-Phe(4-NO2)-OH

IUPAC Name: (2R)-2-amino-3-(4-nitrophenyl)propanoic acid;hydrate | CAS Registry Number: 56613-61-7
Synonyms: 4-Nitro-D-phenylalanine hydrate, SureCN8721103, 73611_ALDRICH, 73611_FLUKA, CTK3J1814, MolPort-001-757-889, ANW-32556, AG-F-56135, OR14535, AC-11789, KB-40096, (2R)-2-Amino-3-(4-nitrophenyl)propanoic acid hydrate

Molecular Formula:	C₉H₁₂N₂O₅	Molecular Weight:	228.201980 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	6

InChIKey: OLZDHJRNUIXKLU-DDWIOCJRSA-N

• Helicid

IUPAC Name: 4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzaldehyde | CAS Registry Number: 80154-34-3
Synonyms: HELECIN, ZINC05234422

Molecular Formula:	C₁₃H₁₆O₇	Molecular Weight:	284.261940 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	7

InChIKey: OLZAGZCCJJBKNZ-UJPOAAIJSA-N

• Hexythiazox

IUPAC Name: (4S,5S)-5-(4-chlorophenyl)-N-cyclohexyl-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide | CAS Registry Number: 78587-05-0
Synonyms: Savey, Acarflor, Acariflor, Nissorun, Calibre, Matacar, Ordoval, Cesar, Trevi, Zeldox (acaricide), (S,S)-hexythiazox, Hexythiazox [BSI:ISO], PS1079_SUPELCO, 33365_RIEDEL, CHEBI:39328, NA 73, DPX Y5893-9, NCGC00164261-02, LS-151154, (4S,5S)-5-(4-chlorophenyl)-N-cyclohexyl-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide

Molecular Formula:	C₁₇H₂₁ClN₂O₂S	Molecular Weight:	352.878840 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: XGWIJUOSCAQSSV-XHDPSFHLSA-N

• Homoharringtonine

Synonyms: homoharringtonine, Cephalotaxus alkaloid, Homoharringtonine (8CI), C29H39NO9, AIDS003025, NSC 141633, AIDS-003025, BRN 5687925, HSCI1_000363, NSC141633, LS-52751, Cephalotaxine, 4-methyl (2R)-2-hydroxy-2-(4-hydroxy-4-methylpentyl)butanedioate (ester), Cephalotaxine, 4-methyl-, 2-hydroxy-2-(4-hydroxy-4-methylpentyl)butanedioate (ester), Cephalotaxine, 4-methyl (2R)-2-hydroxy-2-(4-hydroxy-4-methylpentyl)butanedioate (ester) (9CI), Cephalotaxine, 4-methyl 2-hydroxy-2-(4-hydroxy-4-methylpentyl)butanedioate (ester), (3(R))-, Cephalotaxine, 4-methyl 2-hydroxy-2-(4-hydroxy-4-methylpentyl)butanedioate (ester), (3(R))- (9CI)

Molecular Formula:	C₂₉H₃₉NO₉	Molecular Weight:	545.621260 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	10

InChIKey: HYFHYPWGAURHIV-ZEDNPHJLSA-N

• Homopiperonylamine

IUPAC Name: 2-(1,3-benzodioxol-5-yl)ethanamine hydrochloride | CAS Registry Number: 1484-85-1
Synonyms: MDE hydrochloride, M1796_SIGMA, 560529_ALDRICH, N-Ethyl-3,4-MDA hydrochloride, NSC 28335, SBB003528, 3,4-Methylenedioxyphenethylamine hydrochloride, 1,3-Benzodioxole-5-ethanamine, hydrochloride, LS-103629, Phenethylamine, 3,4-methylenedioxy-, hydrochloride, 2-(3,4-Methylenedioxyphenyl)ethylamine hydrochloride, 3,4-Methylenedioxy-beta-phenylethylamine hydrochloride, ()-3,4-Methylenedioxy-N-- ethyl- amphetamine hydrochloride, 1653-64-1

Molecular Formula:	C₉H₁₂ClNO₂	Molecular Weight:	201.650080 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: NDYXFQODWGEGNU-UHFFFAOYSA-N

• Homoveratronitrile

IUPAC Name: 2-(3,4-dimethoxyphenyl)acetonitrile | CAS Registry Number: 93-17-4
Synonyms: Veratryl cyanide, VERATRYLCYANIDE, 3,4-Dimethylbenzyl cyanide, 3,4-Dimethoxybenzyl cyanide, 3,4-Dimethoxyphenylacetonitrile, (3,4-Dimethoxyphenyl)acetonitrile, 3,4-Dimethoxybenzylcyanide, Benzeneacetonitrile, 3,4-dimethoxy-, Oprea1_832287, 3,4-Dimethoxybenzeneacetonitrile, WLN: NC1R CO1 DO1, 126349_ALDRICH, IFLab1_000888, Acetonitrile, (3,4-dimethoxyphenyl)-, Acetonitrile, 3,4-(dimethoxyphenyl)-, Acetonitrile, 3,4-dimethoxyphenyl-, NSC 6324, EINECS 202-225-1, NSC6324, 3,4-(Dimethoxyphenyl)acetonitrile

Molecular Formula:	C₁₀H₁₁NO₂	Molecular Weight:	177.199840 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: ASLSUMISAQDOOB-UHFFFAOYSA-N

• Hyaluronic acid

IUPAC Name: (2S,3S,4R,5R,6R)-3-[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-methoxyoxane-2-carboxylate | CAS Registry Number: 9004-61-9
Synonyms: hyaluronate, HYALURONIC ACID, [beta-N-acetyl-D-glucosaminyl(1->4)beta-D-glucuronosyl(1->3)](n)

Molecular Formula:	C₁₅H₂₄NO₁₂-	Molecular Weight:	410.350560 [g/mol]
H-Bond Donor:	6	H-Bond Acceptor:	12

InChIKey: GXMRSXSVVLWYCI-XTLSIONJSA-M

• Hydrochlorothiazide

IUPAC Name: 6-chloro-1,1-dioxo-3,4-dihydro-2H-benzo[e][1,2,4]thiadiazine-7-sulfonamide | CAS Registry Number: 58-93-5
Synonyms: hydrochlorothiazide, Esidrix, Hypothiazide, Esidrex, Oretic, Dichlotiazid, Hidrotiazida, Hydrodiuretic, Hydrosaluric, Servithiazid, Dichlotride, Diclotride, Hypothiazid, Idrotiazide, Megadiuril, Aquarills, Disalunil, Newtolide, Thiuretic, Aquarius

Molecular Formula:	C₇H₈ClN₃O₄S₂	Molecular Weight:	297.739120 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	7

InChIKey: JZUFKLXOESDKRF-UHFFFAOYSA-N

• Hypoxanthine

IUPAC Name: 3,7-dihydropurin-6-one | CAS Registry Number: 68-94-0
Synonyms: hypoxanthine, 6-Hydroxypurine, Sarcine, Sarkine, Sarkin, 6-Oxopurine, Hypoxanthine enol, 9H-Purin-6-ol, Purin-6-ol, Purine analog, Purin-6(1H)-one, Purine-6-ol, 6(1H)-Purinone, 3H-Purin-6-ol, Purin-6(3H)-one, 1vfn, 6-Hydroxy-1H-purine, 9H-Purin-6(1H)-one, Hypoxanthine (VAN), Hypoxanthine-8-14C

Molecular Formula:	C₅H₄N₄O	Molecular Weight:	136.111460 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: FDGQSTZJBFJUBT-UHFFFAOYSA-N

• α-Vitamin E

IUPAC Name: (2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-ol | CAS Registry Number: 59-02-9
Synonyms: alpha-Tocopherol, VITAMIN E, Ephanyl, Phytogermine, Waynecomycin, Viteolin, Eprolin, Vitaped, Esorb, Aquasol E, Mvc Plus, Pheryl-E, Vita plus E, ido-E, Vitamin- E, D-alpha-Tocopherol, Prestwick_653, (+)-alpha-Tocopherol, Tocopherol (R,S), M.V.I. Pediatric

Molecular Formula:	C₂₉H₅₀O₂	Molecular Weight:	430.706100 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: GVJHHUAWPYXKBD-IEOSBIPESA-N

• Idebenone

IUPAC Name: 2-(10-hydroxydecyl)-5,6-dimethoxy-3-methylcyclohexa-2,5-diene-1,4-dione | CAS Registry Number: 58186-27-9
Synonyms: idebenone, Cerestabon, Sovrima, Catena, Mnesis, Avan, Idebenonum [Latin], Idebenona [Spanish], Idebenone [INN:JAN], Idebenone (JAN/INN), SNT-MC17, MLS000759487, MLS001424002, QSA-10, BB_NC-1322, C19H30O5, CV 2619, CV-2619, BRN 2001459, ZINC01542890

Molecular Formula:	C₁₉H₃₀O₅	Molecular Weight:	338.438500 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: JGPMMRGNQUBGND-UHFFFAOYSA-N

• Indole-3-acetamide

IUPAC Name: 2-(1H-indol-3-yl)acetamide | CAS Registry Number: 879-37-8
Synonyms: Indoleacetamide, indole-3-acetamide, 1H-Indole-3-acetamide, 3-Indoleacetamide, 3-Indolylacetamide, (indol-3-yl)acetamide, 2-(3-Indolyl)acetamide, 2-(1H-Indol-3-yl)acetamide, Indole-3-acetamide (8CI), Oprea1_704903, 286281_ALDRICH, CID397, NSC 1969, CHEBI:16031, CPD-237, Indole-3-acetamide (6CI,8CI), NSC1969, AIDS019635, AIDS-019635, EINECS 212-904-4

Molecular Formula:	C₁₀H₁₀N₂O	Molecular Weight:	174.199200 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: ZOAMBXDOGPRZLP-UHFFFAOYSA-N

• Indole-3-butyric acid

IUPAC Name: 4-(1H-indol-3-yl)butanoic acid | CAS Registry Number: 133-32-4
Synonyms: Indolebutyric acid, Seradix, Hormodin, Jiffy grow, 3-Indolebutyric acid, Indolbutyric acid, Rhizopon AA, Seradix 2, Seradix 3, Oxyberon, Hormex rooting powder, Rootone, Hormex, Indole butyric acid, Indole-3-butanoic acid, Seradix B 2, Seradix B 3, beta-Iba, Stim-Root, Caswell No. 499

Molecular Formula:	C₁₂H₁₃NO₂	Molecular Weight:	203.237120 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: JTEDVYBZBROSJT-UHFFFAOYSA-N

• Indole-3-carboxylic acid

IUPAC Name: 1H-indole-3-carboxylic acid | CAS Registry Number: 771-50-6
Synonyms: 1H-Indole-3-carboxylic acid, Oprea1_560034, CHEBI:24809, 284734_ALDRICH, EINECS 212-231-6, ALBB-007628, CID69867, SBB003952, SDCCGMLS-0065969.P001, LS-81440, TL806406, I-2320, InChI=1/C9H7NO2/c11-9(12)7-5-10-8-4-2-1-3-6(7)8/h1-5,10H,(H,11,12, ICO

Molecular Formula:	C₉H₇NO₂	Molecular Weight:	161.157380 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: KMAKOBLIOCQGJP-UHFFFAOYSA-N

• Inosine

IUPAC Name: 9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one | CAS Registry Number: 58-63-9
Synonyms: inosine, Hypoxanthosine, Trophicardyl, Ribonosine, Oxiamin, Atorel, Selfer, Pantholic-L, Panholic-L, beta-Inosine, riboxine, iso-prinosine, Inosie, Inosin, Inotin, Hypoxanthine riboside, hypoxanthine-ribose, Hypoxanthine D-riboside, Hypoxanthine nucleoside, 2ada

Molecular Formula:	C₁₀H₁₂N₄O₅	Molecular Weight:	268.226080 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	8

InChIKey: UGQMRVRMYYASKQ-KQYNXXCUSA-N

• Ipriflavone

IUPAC Name: 3-phenyl-7-propan-2-yloxychromen-4-one | CAS Registry Number: 35212-22-7
Synonyms: ipriflavone, Osten, Osteoquine, Yambolap, Quinogin, Iprosten, Osteochin, Osteofix, (Ipriflavone), 7-Isopropoxyisoflavone, Osten (TN), Ipriflavone [INN:JAN], Ipriflavonum [INN-Latin], Ipriflavona [INN-Spanish], Ipriflavone (JAN/INN), CCRIS 1920, Oprea1_106310, Oprea1_275552, MLS000069470, MLS000759494

Molecular Formula:	C₁₈H₁₆O₃	Molecular Weight:	280.317840 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: SFBODOKJTYAUCM-UHFFFAOYSA-N

• Isoamyl butyrate

IUPAC Name: 3-methylbutyl butanoate | CAS Registry Number: 106-27-4
Synonyms: Isoamyl butanoate, Isopentyl butyrate, Isoamyl butylate, Isoamyl-n-butyrate, 3-Methylbutyl butyrate, Butyric acid, isopentyl ester, ISOPENTYL BUTANOATE, 3-Methylbutyl butanoate, Isoamyl butyrate (natural), Isopentyl alcohol, butyrate, Butyric acid isoamylester, Butanoic acid, 3-methylbutyl ester, FEMA No. 2060, CCRIS 6556, W206008_ALDRICH, W206016_ALDRICH, NSC 6548, EINECS 203-380-8, NSC6548, BRN 1702557

Molecular Formula:	C₉H₁₈O₂	Molecular Weight:	158.238020 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: PQLMXFQTAMDXIZ-UHFFFAOYSA-N

• Isonipecotic acid

IUPAC Name: piperidine-4-carboxylic acid | CAS Registry Number: 498-94-2
Synonyms: 4-Piperidinecarboxylic acid, Hexahydroisonicotinic acid, 4-Carboxypiperidine, Piperidine-4-carboxylic acid, Isonicotinic acid, hexahydro-, 4-Hexahydroisonicotinic acid, Lopac-I18008, Acide isonipecotique [French], Piperidin-4-carboxylic acid, Lopac0_000705, I18008_ALDRICH, MLS000069407, 80650_FLUKA, EINECS 207-872-3, NSC 61049, NSC61049, BRN 0112553, SBB004231, Acide piperidine-carboxylique-4 [French], NCGC00015573-01

Molecular Formula:	C₆H₁₁NO₂	Molecular Weight:	129.157040 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: SRJOCJYGOFTFLH-UHFFFAOYSA-N

• Isoquinoline-1-Carboxylic Acid

IUPAC Name: isoquinoline-1-carboxylic acid | CAS Registry Number: 486-73-7
Synonyms: 1-Isoquinolinecarboxylic acid, Isoquinoline-1-carboxylic acid, 150134_ALDRICH, 58752_FLUKA, ALBB-005987, EINECS 207-639-6, NSC218351, AI3-61946, ST5308467

Molecular Formula:	C₁₀H₇NO₂	Molecular Weight:	173.168080 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: XAAKCCMYRKZRAK-UHFFFAOYSA-N

• Isovanillic acid

IUPAC Name: 3-hydroxy-4-methoxybenzoic acid | CAS Registry Number: 645-08-9
Synonyms: Acide isovanillique, 3-Hydroxyanisic acid, 3-Hydroxy-p-anisic acid, p-Anisic acid, 3-hydroxy-, 3-HYDROXY-4-METHOXYBENZOIC ACID, 220108_ALDRICH, EINECS 211-430-5, Benzoic acid, 3-hydroxy-4-methoxy-, BRN 2208365, LS-20099, ST5406548, TL8004579, 4-10-00-01460 (Beilstein Handbook Reference), InChI=1/C8H8O4/c1-12-7-3-2-5(8(10)11)4-6(7)9/h2-4,9H,1H3,(H,10,11

Molecular Formula:	C₈H₈O₄	Molecular Weight:	168.146720 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: LBKFGYZQBSGRHY-UHFFFAOYSA-N

• Itopride free base

IUPAC Name: N-[[4-(2-dimethylaminoethyloxy)phenyl]methyl]-3,4-dimethoxybenzamide | CAS Registry Number: 122898-67-3
Synonyms: Itopride, Itax, UNII-81BMQ80QRL, CID3792, NCGC00167529-01, L002674, N-(p-(2-(Dimethylamino)ethoxy)benzyl)veratramide

Molecular Formula:	C₂₀H₂₆N₂O₄	Molecular Weight:	358.431440 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: QQQIECGTIMUVDS-UHFFFAOYSA-N

• Ketoconazole

IUPAC Name: 1-[4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]ethanone | CAS Registry Number: 65277-42-1
Synonyms: ketoconazole, Fungarest, Fungoral, Ketoderm, Nizoral, Ketoconazol, Ketoisdin, Panfungol, Xolegel, Extina, Orifungal M, Nizoral a-D, (+)-Ketoconazole, Prestwick_744, Ambap5952, Tocris-1103, (2R,4S)-ketoconazole, Prestwick0_000389, Prestwick1_000389, Prestwick2_000389

Molecular Formula:	C₂₆H₂₈Cl₂N₄O₄	Molecular Weight:	531.430920 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	7

InChIKey: XMAYWYJOQHXEEK-OZXSUGGESA-N

• Ketoprofen

IUPAC Name: 2-[3-(benzoyl)phenyl]propanoic acid | CAS Registry Number: 22071-15-4
Synonyms: ketoprofen, Orudis, Ketoprophene, Ketoprofene, Alrheumun, Capisten, Profenid, Oruvail, Epatec, Aneol, Alrheumat, Alrheumum, Actron, racemic-Ketoprofen, Ketoprofen (+-), Orudis KT, m-Benzoylhydratropic acid, Orudis (TN), Prestwick_617, 3-Benzoylhydratropic acid

Molecular Formula:	C₁₆H₁₄O₃	Molecular Weight:	254.280560 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: DKYWVDODHFEZIM-UHFFFAOYSA-N

• Ketotifen fumarate

Synonyms: Zaditen, KETOTIFEN FUMARATE, Zaditor, Alaway, Prestwick_743, Zaditen (TN), Ketotifen fumarate salt, HC 20,511 fumarate, Ketotifen hydrogen fumarate, Ketotifen fumarate [USAN:JAN], MLS000069701, MLS000758236, MLS001148200, MLS001401421, K2628_SIGMA, SPECTRUM1500668, C19H21NOS.C4H4O4, EINECS 252-100-0, Ketotifen Fumarate (JP15/USAN), NCGC00094057-01

Molecular Formula:	C₂₃H₂₃NO₅S	Molecular Weight:	425.497420 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	6

InChIKey: YNQQEYBLVYAWNX-WLHGVMLRSA-N

• Kinetin

IUPAC Name: N-(furan-2-ylmethyl)-7H-purin-6-amine | CAS Registry Number: 525-79-1
Synonyms: kinetin, Cytokinin, 6-Furfuryladenine, Cytex, N6-Furfuryladenine, N-Furfuryladenine, Kinetin solution, Kinetin (VAN), Adenine, N-furfuryl-, 6-Furfurylaminopurine, 6-(Furfurylamino)purine, Kinetin (plant hormone), Prestwick_965, Kinetin hydrochloride, Caswell No. 272D, N6-(Furfurylamino)purine, Spectrum_001064, N(sup 6)-Furfuryladenine, Furfuryl(purin-6-yl)amine, Maybridge1_007141

Molecular Formula:	C₁₀H₉N₅O	Molecular Weight:	215.211360 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	6

InChIKey: QANMHLXAZMSUEX-UHFFFAOYSA-N

• L-Carnitine

IUPAC Name: (3R)-3-hydroxy-4-(trimethylazaniumyl)butanoate | CAS Registry Number: 541-15-1
Synonyms: L-carnitine, Levocarnitine, Carnitine, vitamin BT, Carnitor, (R)-Carnitine, (-)-Carnitine, Carnitene, Karnitin, bicarnesine, (-)-L-Carnitine, Carniking, Carnilean, Carnitolo, Carnovis, Carrier, Lefcar, Metina, (S)-carnitine, L-(-)-Carnitine

Molecular Formula:	C₇H₁₅NO₃	Molecular Weight:	161.198900 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: PHIQHXFUZVPYII-ZCFIWIBFSA-N

• L-Glyceraldehyde acetonide

IUPAC Name: (4S)-2,2-dimethyl-1,3-dioxolane-4-carbaldehyde | CAS Registry Number: 22323-80-4
Synonyms: (S)-2,2-Dimethyl-1,3-dioxolane-4-carbaldehyde, (S)-Glyceraldehyde acetonide, 1,3-Dioxolane-4-carboxaldehyde, 2,2-dimethyl-, (S)-, S-(-)-Solketaldehyde, MFCD00269683, PubChem6340, L-Glyceraldehyde-acetonide, SCHEMBL2257240, MolPort-002-343-971, YSGPYVWACGYQDJ-RXMQYKEDSA-N, ZINC1575688, FCH919857, ZINC01575688, (2S)-2,3-Isopropylidenedioxypropanal, 2,3-o-isopropylidene-l-glyceraldehyde, AKOS024437711, EBD2217329, GS-6048, AC-11081, AJ-27278

Molecular Formula:	C₆H₁₀O₃	Molecular Weight:	130.143 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: YSGPYVWACGYQDJ-RXMQYKEDSA-N

• L-Thyroxine sodium salt pentahydrate

IUPAC Name: sodium 2-amino-3-[4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodophenyl]propanoate pentahydrate | CAS Registry Number: 6106-07-6
Synonyms: L-thyroxine, t4

Molecular Formula:	C₁₅H₂₀I₄NNaO₉	Molecular Weight:	888.928250 [g/mol]
H-Bond Donor:	7	H-Bond Acceptor:	10

InChIKey: JMHCCAYJTTWMCX-UHFFFAOYSA-M