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• A-Methylnaphthalene

IUPAC Name: 1-methylnaphthalene | CAS Registry Number: 90-12-0
Synonyms: 1-METHYLNAPHTHALENE, alpha-Methylnaphthalene, Naphthalene, 1-methyl-, Methyl naphthalene, Polymethylnaphthalene, .alpha.-Methylnaphthalene, 1-Methyl naphthalene, Naphthalene, methyl-, alpha-methyl naphthalenes, FEMA Number 3193, Naphthalene, alpha-methyl-, FEMA No. 3193, CCRIS 6151, M56808_ALDRICH, HSDB 5268, W319309_ALDRICH, 442430_SUPELCO, 45795_RIEDEL, WLN: L66J B1, NSC 3574

Molecular Formula:	C₁₁H₁₀	Molecular Weight:	142.197100 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: QPUYECUOLPXSFR-UHFFFAOYSA-N

• ABTS diammonium salt

IUPAC Name: (2E)-3-ethyl-2-[(Z)-(3-ethyl-6-sulfo-1,3-benzothiazol-2-ylidene)hydrazinylidene]-1,3-benzothiazole-6-sulfonic acid | CAS Registry Number: 30931-67-0
Synonyms: ABTS, 2,2'-Azino-di-(3-ethylbenzothiazoline)-6-sulfonic acid, 2,2'-Azinodi-(3-ethylbenzothiazoline)-(6)-sulfonic acid, ammonium salt, 6-Benzothiazolesulfonic acid, 2,2'-azinobis(3-ethyl-2,3-dihydro-, diammonium salt, 28752-68-3

Molecular Formula:	C₁₈H₁₈N₄O₆S₄	Molecular Weight:	514.618720 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	10

InChIKey: ZTOJFFHGPLIVKC-YAFCTCPESA-N

• Acerola

IUPAC Name: [(2S,5R)-5-(6-aminopurin-9-yl)oxolan-2-yl]methanol | CAS Registry Number: 4097-22-7
Synonyms: dideoxyadenosine, ddAdo, 2',3'-Dideoxyadenosine, ddA (Antiviral), ddA & GM-CSF, CCRIS 428, MLS001055366, D1285_SIGMA, NSC-98700, ADENOSINE, 2',3'-DIDEOXY-, EINECS 223-853-2, NSC 98700, AIDS000003, AIDS000887, C10H13N5O2, AIDS-000003, AIDS-000887, DRG-0039, NSC98700, BRN 0619924

Molecular Formula:	C₁₀H₁₃N₅O₂	Molecular Weight:	235.242520 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	7

InChIKey: WVXRAFOPTSTNLL-NKWVEPMBSA-N

• Acetonyl Acetone

IUPAC Name: hexane-2,5-dione | CAS Registry Number: 110-13-4
Synonyms: Acetonylacetone, 2,5-HEXANEDIONE, Acetonyl acetone, Diacetonyl, 2,5-Diketohexane, Acetone, acetonyl-, 2,5-Hexadione, acetone, acetonyl, 1,2-Diacetylethane, Hexane-2,5-dione, 2,5-Hexandione, ACAN, alpha,beta-Diacetylethane, .alpha.,.beta.-Diacetylethane, CCRIS 2919, MLS001065580, 165131_ALDRICH, WLN: 1V2V1, NSC 7621, 00770_FLUKA

Molecular Formula:	C₆H₁₀O₂	Molecular Weight:	114.142400 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: OJVAMHKKJGICOG-UHFFFAOYSA-N

• Acetyl Acetone (2 4-Pentanedione)

IUPAC Name: pentane-2,4-dione | CAS Registry Number: 123-54-6
Synonyms: Acetylacetone, 2,4-Pentanedione, Acetoacetone, Diacetylmethane, Pentanedione, 2,4-Dioxopentane, Pentane-2,4-dione, 2,4-Pentadione, ACAC, Acetone, acetyl-, Pentanedione-2,4, Acetyl 2-propanone, Hacac, Pentan-2,4-dione, 2-Propanone, acetyl-, ACETYL ACETONE, CCRIS 3466, NCIOpen2_000702, Benzil-related compound, 44, HSDB 2064

Molecular Formula:	C₅H₈O₂	Molecular Weight:	100.115820 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: YRKCREAYFQTBPV-UHFFFAOYSA-N

• Acetyl Butyryl

IUPAC Name: hexane-2,3-dione | CAS Registry Number: 3848-24-6
Synonyms: Acetylbutyryl, Acetyl butyryl, Butyryl acetyl, 2,3-HEXANEDIONE, Methyl propyl diketone, FEMA No. 2558, W255807_ALDRICH, 144169_ALDRICH, EINECS 223-350-8, NSC 31665, NSC31665, BRN 1699896, ZINC01663923, AI3-35989, LS-2795, 4-01-00-03687 (Beilstein Handbook Reference), C043231

Molecular Formula:	C₆H₁₀O₂	Molecular Weight:	114.142400 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: MWVFCEVNXHTDNF-UHFFFAOYSA-N

• Acetylpyrazine

IUPAC Name: 1-pyrazin-2-ylethanone | CAS Registry Number: 22047-25-2
Synonyms: 2-ACETYLPYRAZINE, Pyrazine der., 1-Pyrazinylethanone, Ethanone, 1-pyrazinyl-, Ketone, methyl pyrazinyl, Methyl pyrazinyl ketone, Ethanone, l-pyrazinyl-, Pyrazin-1-ylethan-1-one, FEMA No. 3126, 1-Pyrazin-2-ylethan-1-one, W312606_ALDRICH, 251801_ALDRICH, EINECS 244-753-5, NSC 72374, AIDS070645, AIDS-070645, NSC72374, SBB006738, ZINC00163730, AI3-34445

Molecular Formula:	C₆H₆N₂O	Molecular Weight:	122.124640 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: DBZAKQWXICEWNW-UHFFFAOYSA-N

• Aldehyde C-11 Undecylenic

IUPAC Name: undec-10-enal | CAS Registry Number: 112-45-8
Synonyms: 10-Undecenal, Hendecenal, Undecylenic aldehyde, Undecylenaldehyde, 10-Hendecenal, 1-Undecen-10-al, 10-Undecylenealdehyde, Undec-10-enal, 10-UNDECEN-1-AL, C-11 aldehyde, undecylenic, Aldehyde C-11, undecylenic, FEMA No. 3095, WLN: VH9U1, W309508_ALDRICH, 132276_ALDRICH, EINECS 203-973-1, NSC 44900, NSC44900, BRN 1746480, LMFA06000067

Molecular Formula:	C₁₁H₂₀O	Molecular Weight:	168.275900 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: OFHHDSQXFXLTKC-UHFFFAOYSA-N

• Allylthiourea

IUPAC Name: prop-2-enylthiourea | CAS Registry Number: 109-57-9
Synonyms: Thiosinamine, N-Allylthiourea, ALLYLTHIOUREA, Thiosinamin, Rhodallin, Rhodalline, Aminosin, Allyl thiourea, 1-Allylthiourea, Thiocynamine, Thiosinaminum, Tiosinamin, Tiosinamine, Allylthiocarbamide, alylthiourea, 1-Allyl-2-thiourea, Thiourea, 2-propenyl-, Allylthiourea [INN], (2-Propenyl)thiourea, Aliltiourea [Spanish]

Molecular Formula:	C₄H₈N₂S	Molecular Weight:	116.184720 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	0

InChIKey: HTKFORQRBXIQHD-UHFFFAOYSA-N

• Alpha Olefin C14

IUPAC Name: tetradec-1-ene | CAS Registry Number: 1120-36-1
Synonyms: 1-TETRADECENE, n-Tetradec-1-ene, Tetradecane, 1-Tetradecylene, alpha-Tetradecene, Tetradec-1-ene, CCRIS 3785, T9805_ALDRICH, Alkenes, C14-18 alpha-, Alkenes, C14-20 alpha-, (C14-C18) alpha-Olefin, (C14-C20) alpha-Olefin, HSDB 1087, 442278_SUPELCO, Alkenes, C10-16 .alpha.-, 87187_FLUKA, 87189_FLUKA, EINECS 214-306-9, NSC 66434, NSC66434

Molecular Formula:	C₁₄H₂₈	Molecular Weight:	196.372120 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: HFDVRLIODXPAHB-UHFFFAOYSA-N

• alpha-Bromonaphthalene

IUPAC Name: 1-bromonaphthalene | CAS Registry Number: 90-11-9
Synonyms: Naphthalene, 1-bromo-, 1-Naphthyl bromide, 1-BROMONAPHTHALENE, .alpha.-Bromonaphthalene, alpha-Naphthyl bromide, .alpha.-Naphthyl bromide, 1-Bromonaphthalene solution, B73104_ALDRICH, NSC 6551, 17640_FLUKA, 17650_FLUKA, EINECS 201-965-2, NSC6551, BRN 1906414, AI3-02271, LS-94439, ST5406316, 4-05-00-01665 (Beilstein Handbook Reference), InChI=1/C10H7Br/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7, 27497-51-4

Molecular Formula:	C₁₀H₇Br	Molecular Weight:	207.066580 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: DLKQHBOKULLWDQ-UHFFFAOYSA-N

• Amantadine sulfate

IUPAC Name: adamantan-1-amine; sulfuric acid | CAS Registry Number: 31377-23-8
Synonyms: Amantadine sulphate (INNM), EINECS 250-604-5, Tricyclo(3.3.1.1(3,7))decan-1-amine, sulfate (2:1)

Molecular Formula:	C₂₀H₃₆N₂O₄S	Molecular Weight:	400.575840 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	6

InChIKey: MYWTWSQFJLXGGQ-UHFFFAOYSA-N

• Amino Guanidine Bicarbonate

IUPAC Name: 2-aminoguanidine; carbonic acid | CAS Registry Number: 2582-30-1
Synonyms: Aminoguanidine bicarbonate, Aminoguanidinium bicarbonate, Aminoguanidine hydrocarbonate, Aminoguanidine carbonate (1:1), Aminoguanidine hydrogen carbonate, Aminoguanidium hydrogen carbonate, 1-Aminoguanidine bicarbonate, CCRIS 7133, N1-Aminoguanidine carbonate (1:1), NSC7887, Aminoguanidine hydrogencarbonate, Aminoguanidinium hydrogen carbonate, 109266_ALDRICH, Guanylhydrazine hydrogencarbonate, NSC 7887, EINECS 219-956-7, AIDS155866, Guanidine, amino-, hydrogen carbonate, AIDS-155866, Ba 51-090222 (VAN)

Molecular Formula:	C₂H₈N₄O₃	Molecular Weight:	136.109920 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	7

InChIKey: OTXHZHQQWQTQMW-UHFFFAOYSA-N

• Aminothiazole

IUPAC Name: 1,3-thiazol-2-amine | CAS Registry Number: 96-50-4
Synonyms: aminothiazole, 2-Thiazolamine, Abadole, Basedol, Abadol, 2-AMINOTHIAZOLE, 2-Thiazylamine, 2-Thiazolylamine, 2-Aminothiazol, Thiazole, 2-amino-, 4-Thiazolin-2-onimine, Aminothiazole [INN], Aminotiazolo [DCIT], sFtHLPDISNmLp@, 1,3-Thiazol-2-amine, Aminothiazole (INN), Spectrum_000085, Aminothiazol [INN-French], Aminotiazol [INN-Spanish], Aminothiazolum [INN-Latin]

Molecular Formula:	C₃H₄N₂S	Molecular Weight:	100.142260 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: RAIPHJJURHTUIC-UHFFFAOYSA-N

• Amyl Vinyl Carbinol

IUPAC Name: oct-1-en-3-ol | CAS Registry Number: 3391-86-4
Synonyms: Amyl vinyl carbinol, 1-Vinylhexanol, 1-OCTEN-3-OL, Vinyl amyl carbinol, Amylvinylcarbinol, Matsuica alcohol, Matsutake alcohol, 3-Hydroxy-1-octene, Pentylvinylcarbinol, Vinyl hexanol, 3-Octenol, Mushroom alcohol, Pentyl vinyl carbinol, Oct-1-ene-3-ol, Oct-1-en-3-ol, octene-1-ol-3, 1-Okten-3-ol [Czech], 1-Octen-3-ol (natural), Matsutake alcohol [Japanese], FEMA No. 2805

Molecular Formula:	C₈H₁₆O	Molecular Weight:	128.212040 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: VSMOENVRRABVKN-UHFFFAOYSA-N

• Ancitabine hydrochloride

Synonyms: Cyclocytidine, OCTD hydrochloride, Ancitabin hydrochlorid, Cyclo-cmp hydrochloride, Ancitabin hydrochloride, Cyclocytidine hydrochloride, ANCITABINE HYDROCHLORIDE, C9H11N3O4.HCl, MLS001032024, MLS001173324, 2,2'-Cyclocytidine hydrochloride, Ancitabine hydrochloride (JAN), 2,2'-Anhydrocytidine hydrochloride, 2,2'-O-Cyclocytidine hydrochloride, EINECS 233-515-6, 2,2'-Anhydrocytarabine hydrochloride, 2,2'-Anhydroaracytidine hydrochloride, 2,2'-Cyclocytidine, monohydrochloride, NSC 145668, NSC-145668

Molecular Formula:	C₉H₁₂ClN₃O₄	Molecular Weight:	261.662280 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	7

InChIKey: KZOWNALBTMILAP-JBMRGDGGSA-N

• Azacyclonol

IUPAC Name: di(phenyl)-piperidin-4-ylmethanol | CAS Registry Number: 115-46-8
Synonyms: Frenquel, gamma-Pipradol, Prestwick_84, Azaciclonolo [DCIT], Azacyclonolum [INN-Latin], Azacyclonol [INN:BAN], Maybridge3_001033, Prestwick0_000093, Prestwick1_000093, Prestwick2_000093, Prestwick3_000093, alpha-(4-Piperidyl)benzhydrol, MER 17, Oprea1_114075, Oprea1_848733, BSPBio_000046, Diphenyl-piperidin-4-yl-methanol, MLS000558844, MLS001201777, SPBio_001985

Molecular Formula:	C₁₈H₂₁NO	Molecular Weight:	267.365440 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: ZMISODWVFHHWNR-UHFFFAOYSA-N

• BAPTA

IUPAC Name: tetrapotassium 2-[2-[2-[2-[bis(2-oxido-2-oxoethyl)amino]phenoxy]ethoxy]-N-(2-oxido-2-oxoethyl)anilino]acetate | CAS Registry Number: 85233-19-8
Synonyms: CID126423, Glycine, N,N'-(1,2-ethanediylbis(oxy-2,1-phenylene))bis(N-(carboxymethyl)-, tetrapotassium salt, 73630-08-7

Molecular Formula:	C₂₂H₂₀K₄N₂O₁₀	Molecular Weight:	628.794800 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	12

InChIKey: MAWIDOKQOLSOFT-UHFFFAOYSA-J

• BAPTA-AM

IUPAC Name: acetyloxymethyl 2-[N-[2-(acetyloxymethoxy)-2-oxoethyl]-2-[2-[2-[bis[2-(acetyloxymethoxy)-2-oxoethyl]amino]phenoxy]ethoxy]anilino]acetate | CAS Registry Number: 126150-97-8
Synonyms: BAPTA/AM, BSPBio_001472, A1076_SIGMA, Bio1_000382, 11696_FLUKA, CID2293, OR2370T, Bio1_000871, Bio1_001360, NCGC00163427-01, NCGC00163427-02, BRD-K40919711-001-02-4, 1,2-Bis(2-aminophenoxy)ethane-N,N,N',N'-tetraacetic acid tetrakis(acetoxymethyl ester), 1,2-bis(o-AMINOPHENOXY)ETHANE-N,N,N',N'-TETRAACETIC ACID TETRAACETOXYMETHYL ESTER, 1,2-bis(o-Aminophenoxy)ethane-N,N,N′,N′-tetraacetic Acid Tetra(acetoxymethyl) Ester

Molecular Formula:	C₃₄H₄₀N₂O₁₈	Molecular Weight:	764.684000 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	20

InChIKey: YJIYWYAMZFVECX-UHFFFAOYSA-N

• Baranol

IUPAC Name: (3S)-3,7-dimethyloct-6-en-1-ol | CAS Registry Number: 7540-51-4
Synonyms: Citronellol, Rhodinol, Cephrol, Rodinol, Elenol, (-)-Citronellol, beta-Rhodinol, l-Citronellol, DL-Citronellol, (3S)-citronellol, Citronellol (natural), (S)-(-)-citronellol, CHEBI:88, FEMA No. 2309, 2,6-Dimethyl-2-octen-8-ol, CCRIS 7452, W509205_ALDRICH, 6-Octen-1-ol, 3,7-dimethyl-, 303488_ALDRICH, NSC 8779

Molecular Formula:	C₁₀H₂₀O	Molecular Weight:	156.265200 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: QMVPMAAFGQKVCJ-JTQLQIEISA-N

• Benzene, 1-bromo-3-fluoro-

IUPAC Name: 1-bromo-3-fluorobenzene | CAS Registry Number: 1073-06-9
Synonyms: m-Bromofluorobenzene, m-Fluorobromobenzene, 3-Bromofluorobenzene, m-Fluorophenyl bromide, 3-Bromfluorbenzen, 1-Fluoro-3-bromobenzene, 1-BROMO-3-FLUOROBENZENE, 3-Bromfluorbenzen [Czech], Benzene, 1-fluoro-3-bromo-, WLN: FR CE, B67007_ALDRICH, EINECS 214-023-0, NSC 10267, NSC10267, LS-30353, TL806401, ST5406324, InChI=1/C6H4BrF/c7-5-2-1-3-6(8)4-5/h1-4

Molecular Formula:	C₆H₄BrF	Molecular Weight:	174.998363 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: QDFKKJYEIFBEFC-UHFFFAOYSA-N

• Benzyl-5-phenylbarbituric acid

IUPAC Name: 5-phenyl-1-(phenylmethyl)-1,3-diazinane-2,4,6-trione | CAS Registry Number: 72846-00-5
Synonyms: 1-Benzyl-5-phenylbarbituric acid, EINECS 276-940-2, CID166340, ZINC00156356, 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-phenyl-1-(phenylmethyl)-

Molecular Formula:	C₁₇H₁₄N₂O₃	Molecular Weight:	294.304660 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: KCWWCWMGJOWTMY-UHFFFAOYSA-N

• Beta-D-Ribopyranose 1,2,3,4-Tetraacetate

IUPAC Name: [(2S,3R,4R,5R)-2,3,5-triacetyloxyoxan-4-yl] acetate | CAS Registry Number: 4049-34-7
Synonyms: Lyxopyranose, tetraacetate, Tetra-O-acetyl-beta-D-ribopyranose, CID97336, EINECS 223-750-2, ZINC04557395

Molecular Formula:	C₁₃H₁₈O₉	Molecular Weight:	318.276620 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	9

InChIKey: MJOQJPYNENPSSS-LPWJVIDDSA-N

• Bicuculline

IUPAC Name: (6R)-6-[(5S)-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-6H-furo[3,4-g][1,3]benzodioxol-8-one | CAS Registry Number: 485-49-4
Synonyms: bicuculline, Bicculine, d-Bicuculline, Bicucullin, Bicuculline (+), ()-Bicuculline, Prestwick_96, (+)-Bicuculline, Prestwick0_000589, Prestwick1_000589, Prestwick2_000589, Prestwick3_000589, Biomol-NT_000252, Lopac0_000234, BSPBio_000438, MLS002153892, DivK1c_000609, SPBio_002657, BPBio1_000482, BPBio1_000794

Molecular Formula:	C₂₀H₁₇NO₆	Molecular Weight:	367.352080 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	7

InChIKey: IYGYMKDQCDOMRE-ZWKOTPCHSA-N

• Bis (Trimethylsiloxy) Ethane

IUPAC Name: trimethyl(2-trimethylsilyloxyethoxy)silane | CAS Registry Number: 7381-30-8
Synonyms: 1,2-Bis(trimethylsiloxy)ethane, 225800_ALDRICH, 15232_FLUKA, EINECS 230-950-3, Ethylene glycol bis(trimethylsilyl ether), 3,6-Dioxa-2,7-disilaoctane, 2,2,7,7-tetramethyl-, 2,2,7,7-Tetramethyl-3,6-dioxa-2,7-disilaoctane

Molecular Formula:	C₈H₂₂O₂Si₂	Molecular Weight:	206.430080 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: JGWFUSVYECJQDT-UHFFFAOYSA-N

• Bis(Trichlorosilyl)-Ethane

IUPAC Name: trichloro(2-trichlorosilylethyl)silane | CAS Registry Number: 2504-64-5
Synonyms: 1,2-Bis(trichlorosilyl)ethane, Ethylenebis(trichlorosilane), 447048_ALDRICH, Silane, 1,2-ethanediylbis[trichloro-, CID75631, EINECS 219-710-9, Silane, 1,2-ethanediylbis(trichloro-, 1,1,1,4,4,4-Hexachlorodisilethylene

Molecular Formula:	C₂H₄Cl₆Si₂	Molecular Weight:	296.942160 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: WDVUXWDZTPZIIE-UHFFFAOYSA-N

• Bithionol sulfoxide

IUPAC Name: 2,4-dichloro-6-(3,5-dichloro-2-hydroxyphenyl)sulfinylphenol | CAS Registry Number: 844-26-8
Synonyms: Bithionoloxide, Distobitin, Sulphene, Bithionoloxidum, Bitionoloxido, Bitin S, Disto-5-cogla, Bitin-S, Bithionoloxidum [Latin], Bitionoloxido [Spanish], Bithionoloxide [INN], CCRIS 2045, C12H6Cl4O3S, UNII-6PL3DO2B30, Oprea1_667190, S8259_SIGMA, EINECS 212-679-2, 2,2'-Sulfinylbis(4,6-dichlorophenol), 6,6'-Sulfinylbis(2,4-dichlorophenol), NSC 523910

Molecular Formula:	C₁₂H₆Cl₄O₃S	Molecular Weight:	372.051240 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: RPAJWWXZIQJVJF-UHFFFAOYSA-N

• Boc-L-Amino acid

IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid | CAS Registry Number: 34306-42-8
Synonyms: NSC335382, CID333522

Molecular Formula:	C₉H₁₇NO₄	Molecular Weight:	203.235580 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: PNFVIPIQXAIUAY-UHFFFAOYSA-N

• Brefeldin A

IUPAC Name: (1R,2S,3E,7S,11E,13S,15S)-2,15-dihydroxy-7-methyl-6-oxabicyclo[11.3.0]hexadeca-3,11-dien-5-one | CAS Registry Number: 20350-15-6
Synonyms: Ascotoxin, brefeldin A, Decumbin, Cyanein, Lunatin, Nectrolide, Synergisidin, Cyanaein, (+)-Brefeldin A, Pfizer B 174987, NSC56310, NSC89671, PFIZER B174987, NSC107456, NSC244390, AIDS003358, Antibiotic from Penicillium cyaneum, AIDS-003358, CID5351204, B 174987

Molecular Formula:	C₁₆H₂₄O₄	Molecular Weight:	280.359360 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: KQNZDYYTLMIZCT-PNFJWZTBSA-N

• Bromomethyl-cyclopropane

IUPAC Name: bromomethylcyclopropane | CAS Registry Number: 7051-34-5
Synonyms: Bromomethylcyclopropane, (Bromomethyl)cyclopropane, Cyclopropylmethyl bromide, bromomethyl-cyclopropane, Cyclopropane, (bromomethyl)-, 242403_ALDRICH, BB_SC-4711, CID81503, EINECS 230-331-8, C2498G5

Molecular Formula:	C₄H₇Br	Molecular Weight:	135.002380 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: AEILLAXRDHDKDY-UHFFFAOYSA-N

• Bronopol

IUPAC Name: 2-bromo-2-nitropropane-1,3-diol | CAS Registry Number: 52-51-7
Synonyms: bronopol, Bronocot, Bronosol, Bronidiol, Bronotak, Lexgard bronopol, Onyxide 500, Bronopolu [Polish], Caswell No. 116A, Bronopolum [INN-Latin], 2-Bromo-2-nitro-1,3-propanediol, 2-Bromo-2-nitropropane-1,3-diol, C3H6BrNO4, WLN: WNXE1Q1Q, 1,3-Propanediol, 2-bromo-2-nitro-, Bronopol [BAN:INN:JAN], Bronopol [INN:BAN:JAN], 2-Nitro-2-bromo-1,3-propanediol, Bronopol (JAN/USAN/INN), HSDB 7195

Molecular Formula:	C₃H₆BrNO₄	Molecular Weight:	199.988040 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: LVDKZNITIUWNER-UHFFFAOYSA-N

• Butadiene diepoxide

IUPAC Name: 2-(oxiran-2-yl)oxirane | CAS Registry Number: 1464-53-5
Synonyms: Diepoxybutane, Dioxybutadiene, Bioxirane, 2,2'-Bioxirane, Butane diepoxide, Bioxiran, Butadiene dioxide, D,L-Diepoxybutane, Butadiendioxyd, Erythritol anhydride, meso-Diepoxybutane, L-Diepoxybutane, Diepoxybutane, dl-, dl-Butadiene dioxide, 1,3-Butadiene diepoxide, meso-Butadiene epoxide, 1,2,3,4-Diepoxybutane, 2,4-Diepoxybutane, L(+)-Diepoxybutane, Butadiendioxyd [German]

Molecular Formula:	C₄H₆O₂	Molecular Weight:	86.089240 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: ZFIVKAOQEXOYFY-UHFFFAOYSA-N

• Butene-1,4-Diol

IUPAC Name: (E)-but-2-ene-1,4-diol | CAS Registry Number: 110-64-5
Synonyms: Butenediol, Penitricin C, 2-Butene-1,4-diol, Agrisynth B2D, 1,4-Butenediol, Caswell No. 120, 2-Buten-1,4-diol, 1,4-DIHYDROXY-2-BUTENE, 2-Butene, 1,4-dihydroxy-, trans-2-Butene-1,4-diol, HSDB 5540, NSC 1260, (2E)-but-2-ene-1,4-diol, EINECS 203-787-0, 2-Butene-1,4-diol, (E)-, 2-butene-1,4-diol, (2E)-, EPA Pesticide Chemical Code 220100, 2-BUTENE-1,4-DIOL (TRANS), AI3-07551, LS-2083

Molecular Formula:	C₄H₈O₂	Molecular Weight:	88.105120 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: ORTVZLZNOYNASJ-OWOJBTEDSA-N

• Butyl Carbitol

IUPAC Name: 2-(2-butoxyethoxy)ethanol | CAS Registry Number: 112-34-5
Synonyms: Butyl carbitol, Butoxydiglycol, Butoxyethoxyethanol, Butyl diglycol, Butyl dioxitol, Butyl digol, Dowanol DB, Jeffersol db, Butyldiglycol, Ektasolve DB, Poly-Solv DB, Glycol ether DB, BUCB, DB Solvent, Butoxydiethylene glycol, 2-(2-Butoxyethoxy)ethanol, Butoxy diethylene glycol, Diglycol monobutyl ether, Butyl Ethyl Cellosolve, Caswell No. 121B

Molecular Formula:	C₈H₁₈O₃	Molecular Weight:	162.226720 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: OAYXUHPQHDHDDZ-UHFFFAOYSA-N

• Butyl carbitol acetate

IUPAC Name: 2-(2-butoxyethoxy)ethyl acetate | CAS Registry Number: 124-17-4
Synonyms: Butoxyethoxyethyl acetate, Db acetate, Ektasolve DB acetate, Butyl diglycol acetate, Butyldiglycol acetate, Glycol ether DB aceatate, BUTYL CARBITOL ACETATE, Butylkarbitolacetat [Czech], 2-(2-Butoxyethoxy)ethyl acetate, Butyl diethylene glycol acetate, Diglycol monobutyl ether acetate, Ethanol, 2-(2-butoxyethoxy)-, acetate, HSDB 334, 2-(2-Butoxyethoxy)ethanol acetate, WLN: 4O2O2OV1, Diethylene glycol butyl ether acetate, NSC 5175, 32260_FLUKA, Diethyleneglycol monobutyl ether acetate, EINECS 204-685-9

Molecular Formula:	C₁₀H₂₀O₄	Molecular Weight:	204.263400 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: VXQBJTKSVGFQOL-UHFFFAOYSA-N

• Butyl Cellosolve

IUPAC Name: 2-butoxyethanol | CAS Registry Number: 111-76-2
Synonyms: 2-Butoxyethanol, n-Butoxyethanol, Butyl glycol, Butoxyethanol, Butyl oxitol, Butyl cellosolve, Ethanol, 2-butoxy-, Dowanol EB, Gafcol EB, Jeffersol eb, Butyl cellu-sol, butylcellosolve, Glycol ether eb, Glycol butyl ether, Ektasolve EB, Poly-Solv EB, Butyglycol, Chimec NR, 3-Oxa-1-heptanol, .beta.-Butoxyethanol

Molecular Formula:	C₆H₁₄O₂	Molecular Weight:	118.174160 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: POAOYUHQDCAZBD-UHFFFAOYSA-N

• Butyl Cellosolve Acetate

IUPAC Name: 2-butoxyethyl acetate | CAS Registry Number: 112-07-2
Synonyms: 2-Butoxyethyl acetate, Butoxyethyl acetate, Butylglycol acetate, Butyl glycol acetate, EGBEA, Ektasolve EB acetate, Butylcellosolve acetate, 2-Butoxyethylacetate, n-Butoxyethanol acetate, 2-Butoxyethanol acetate, Butyl cellosolve acetate, 2-Butyloxyethyl acetate, Butylcelosolvacetat [Czech], Ethanol, 2-butoxy-, acetate, 1-Acetoxy-2-butoxyethane, Glycol monobutyl ether acetate, HSDB 435, Acetic acid, 2-butoxyethyl ester, 307289_ALDRICH, 537519_ALDRICH

Molecular Formula:	C₈H₁₆O₃	Molecular Weight:	160.210840 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: NQBXSWAWVZHKBZ-UHFFFAOYSA-N

• Butyl Iodide

IUPAC Name: 1-iodobutane | CAS Registry Number: 542-69-8
Synonyms: 1-Iodobutane, Butyl iodide, Butane, 1-iodo-, N-BUTYL IODIDE, Butane, iodo-, IODOBUTANE, 1-Jodbutan [Czech], sJPHAVIJuP@, nchem.167-comp22, WLN: I4, 167304_ALDRICH, NSC 8420, 20030_FLUKA, EINECS 208-824-4, NSC8420, AI3-52403, LS-45922, InChI=1/C4H9I/c1-2-3-4-5/h2-4H2,1H, 25267-27-0

Molecular Formula:	C₄H₉I	Molecular Weight:	184.018730 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: KMGBZBJJOKUPIA-UHFFFAOYSA-N

• Butylsulfonyl Chloride

IUPAC Name: butane-1-sulfonyl chloride | CAS Registry Number: 2386-60-9
Synonyms: 1-Butanesulfonyl chloride, Butylsulfonyl chloride, Butanesulfonyl chloride, 1-Butylsulfonyl chloride, n-Butanesulphonyl chloride, Butane-1-sulfonyl chloride, n-Butanesulfonyl chloride, Butane-1-sulphonyl chloride, 263605_ALDRICH, NSC 8027, EINECS 219-204-8, NSC8027, BRN 1748742, LS-45991, LS-45992, EK5940000, 4-04-00-00045 (Beilstein Handbook Reference)

Molecular Formula:	C₄H₉ClO₂S	Molecular Weight:	156.631060 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: WEDIIKBPDQQQJU-UHFFFAOYSA-N

• Camphor Sulphonic Acid

IUPAC Name: [(1R)-7,7-dimethyl-2-oxo-1-bicyclo[2.2.1]heptanyl]methanesulfonic acid | CAS Registry Number: 35963-20-3
Synonyms: R-(10)-Camphorsulfonic Acid, EINECS 252-817-9, TL806102, (1R)-(7,7-Dimethyl-2-oxobicyclo(2.2.1)hept-1-yl)methanesulphonic acid

Molecular Formula:	C₁₀H₁₆O₄S	Molecular Weight:	232.296640 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: MIOPJNTWMNEORI-MHPPCMCBSA-N

• Carbitol (Diethylene Glycol Mono Ethyl Ether)

IUPAC Name: 2-(2-ethoxyethoxy)ethanol | CAS Registry Number: 111-90-0
Synonyms: Solvolsol, Transcutol, Dioxitol, Ethoxy diglycol, Ethyl carbitol, Ethyl digol, CARBITOL, Carbitol solvent, Ethoxydiglycol, Losungsmittel apv, Dowanol DE, Transcutol P, Carbitol cellosolve, Ektasolve DE, Ethyldiglycol, Poly-Solv DE, Dowanol, Karbitol [Czech], 2-(2-Ethoxyethoxy)ethanol, Poly-Solv

Molecular Formula:	C₆H₁₄O₃	Molecular Weight:	134.173560 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: XXJWXESWEXIICW-UHFFFAOYSA-N

• Carbitol Acetate

IUPAC Name: 2-(2-ethoxyethoxy)ethyl acetate | CAS Registry Number: 112-15-2
Synonyms: Carbitol acetate, Ethoxydiglycol acetate, DE Acetate, Ektasolve de acetate, Ethyldiglycol acetate, Karbitolacetat [Czech], Glycol ether de acetate, Diglycol monoethyl ether acetate, Ethanol, 2-(2-ethoxyethoxy)-, acetate, 2-(2-ETHOXYETHOXY)ETHYL ACETATE, HSDB 5555, WLN: 2O2O2OV1, Diethylene glycol ethyl ether acetate, 537527_ALDRICH, Diethylene glycol monoethyl ether acetate, 2-(2-Ethoxyethoxy)ethanol acetate, NSC 8702, 32240_FLUKA, EINECS 203-940-1, NSC8702

Molecular Formula:	C₈H₁₆O₄	Molecular Weight:	176.210240 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: FPZWZCWUIYYYBU-UHFFFAOYSA-N

• Carboxy-PTIO potassium

IUPAC Name: potassium 4-(1-hydroxy-4,4,5,5-tetramethyl-3-oxidoimidazol-3-ium-2-yl)benzoate | CAS Registry Number: 148819-94-7
Synonyms: carboxy-ptio, OR8125T, 2-(4-Carboxyphenyl)-4,4,5,5-tetramethylimidazoline-1-oxyl-3-oxide

Molecular Formula:	C₁₄H₁₇KN₂O₄	Molecular Weight:	316.394080 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: UUIUWWWXQKGGKY-UHFFFAOYSA-M

• Carmustine

IUPAC Name: 1,3-bis(2-chloroethyl)-1-nitrosourea | CAS Registry Number: 154-93-8
Synonyms: carmustine, Carmustin, Nitrumon, BCNU, Carmubris, Gliadel, Becenum, BiCNU, Bischlorethylnitrosurea, Bi CNU, Bischlorethylnitrosourea, FIVB, Prestwick_997, Bischloroethylnitrosourea, carmustine in ethanol, BiCNU (TN), Bischloroethyl nitrosourea, 1,3-Bis(2-chloroethyl)-1-nitrosourea, Carmustinum [INN-Latin], Spectrum_000265

Molecular Formula:	C₅H₉Cl₂N₃O₂	Molecular Weight:	214.049860 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: DLGOEMSEDOSKAD-UHFFFAOYSA-N

• Carveol

IUPAC Name: 2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-ol | CAS Registry Number: 99-48-9
Synonyms: CARVEOL, L-Carveol, trans-Carveol, cis-Carveol, L-cis-Carveol, p-Mentha-1,8-dien-6-ol, p-Mentha-6,8-dien-2-ol, (-)-cis-Carveol, cis-(-)-Carveol, (-)-Carveol, (1R)-cis-Carveol, Carveol, cis-(-)-, 6,8-p-Menthadien-2-ol, UPCMLD-DP073, FEMA No. 2247, CCRIS 6219, p-Mentha-1(6),8-dien-2-ol, W224707_ALDRICH, L-p-mentha-6-8-dien-2-ol, (1R,5R)-(-)-cis-Carveol

Molecular Formula:	C₁₀H₁₆O	Molecular Weight:	152.233440 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: BAVONGHXFVOKBV-UHFFFAOYSA-N

• Chelidonine

Synonyms: Stylophorin, Chelidonin, Helidonine, Khelidonin, CHELIDONINE, (+)-Chelidonine, Prestwick0_000587, Prestwick1_000587, Prestwick2_000587, Prestwick3_000587, Benzophenanthridine alkaloid, BSPBio_000434, SPBio_002653, BPBio1_000478, MEGxp0_001421, ACon1_000007, CHEBI:31389, AIDS002651, AIDS-002651, NSC646661 (FREE BASE)

Molecular Formula:	C₂₀H₁₉NO₅	Molecular Weight:	353.368560 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	6

InChIKey: GHKISGDRQRSCII-ZOCIIQOWSA-N

• Chloro Propyl Trimethoxy Silane

IUPAC Name: 3-chloropropyl(trimethoxy)silane | CAS Registry Number: 2530-87-2
Synonyms: (3-Chloropropyl)trimethoxysilane, Sila-Ace S 620, CPS-M, Silane, (3-chloropropyl)trimethoxy-, 3-Chloropropyltrimethyoxysilane, 3-Chloropropyltrimethoxysilane, NCIOpen2_001219, Trimethoxy(3-chloropropyl)silane, Dow Corning product Z-6076, KBM 703, 3-(Trimethoxysilyl)propyl chloride, 440183_ALDRICH, (gamma-Chloropropyl)trimethoxysilane, Silane (3-chloropropyl)tris(methoxy)-, EINECS 219-787-9, gamma-Chloropropyltrimethoxysilane, NSC 83878, (3-chloropropyl)(trimethoxy)silane, .delta.-Chloropropyltrimethoxysilane, .gamma.-Chloropropyltrimethoxysilane

Molecular Formula:	C₆H₁₅ClO₃Si	Molecular Weight:	198.720000 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: OXYZDRAJMHGSMW-UHFFFAOYSA-N

• Cortodoxone

IUPAC Name: (8R,9S,10R,13S,14S,17R)-17-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one | CAS Registry Number: 152-58-9
Synonyms: Cortexolone, 11-Deoxycortisol, Reichstein S, 11-Desoxycortisol, CORTODOXONE, Substance S, 11 Deoxycortisol, 11-Dioxycortisol, 11-Desoxycortisone, Cortodoxone (USAN), Reichstein's substance S, 11-Deoxyhydrocortisone, Cortisol, 11-deoxy-, 11-Desoxyhydrocortisone, Reichstein's compound S, 17alpha-Hydroxycortexone, 17-alpha-Hydroxycortexone, Cortodoxonum [INN-Latin], Substance S, Reichstein's, 11-DEOXY-CORTISOL

Molecular Formula:	C₂₁H₃₀O₄	Molecular Weight:	346.460500 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: WHBHBVVOGNECLV-OBQKJFGGSA-N

• Cotinine

IUPAC Name: 1-methyl-5-pyridin-3-ylpyrrolidin-2-one | CAS Registry Number: 486-56-6
Synonyms: cotinine, Scotine, (-)-Cotinine, (S)-Cotinine, Cotinine [INN], (S)-(-)-Cotinine, Cotininum [INN-Latin], Cotinina [INN-Spanish], CCRIS 7625, C10H12N2O, EINECS 207-634-9, NIH 10498, BRN 0083099, 2-Pyrrolidinone, 1-methyl-5-(3-pyridinyl)-, (S)-, NCGC00093739-01, NCGC00093739-02, NCGC00093739-03, NCGC00093739-04, NCGC00093739-05, NCGC00093739-06

Molecular Formula:	C₁₀H₁₂N₂O	Molecular Weight:	176.215080 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: UIKROCXWUNQSPJ-UHFFFAOYSA-N

• D-(+)-Camphor Sulphonic Acid

IUPAC Name: [(1R,4S)-7,7-dimethyl-2-oxo-1-bicyclo[2.2.1]heptanyl]methanesulfonic acid | CAS Registry Number: 3144-16-9
Synonyms: d-Camphorsulfonic acid, 282146_ALDRICH, (1R)-Camphor-10-sulfonic acid, (−)-Camphor-10-sulfonic acid, (1R)-(−)-10-Camphorsulfonic acid, (1R)-(−)-Camphor-10-sulfonic acid

Molecular Formula:	C₁₀H₁₆O₄S	Molecular Weight:	232.296640 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: MIOPJNTWMNEORI-XVKPBYJWSA-N