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• 2-Chloro-6-pyridinecarboxylic acid
IUPAC Name: 6-chloropyridine-2-carboxylic acid | CAS Registry Number: 4684-94-0
Synonyms: Picolinic acid, 6-chloro-, Caswell No. 214B, 6-CHLOROPICOLINIC ACID, 6-CPA, Enamine_000408, WLN: T6NJ FVQ BG, 2-Pyridinecarboxylic acid, 6-chloro-, 6-Chloro-2-pyridinecarboxylic acid, MLS000774887, TPC-PY068, 680044_ALDRICH, 6-Chloropyridine-2-carboxylic acid, 2-Chloro-6-Pyridinecarboxylic Acid, NSC 51587, EPA Pesticide Chemical Code 069206, NSC51587, BRN 0115849, SMR000368159, TL806373, LS-109652

Molecular Formula: C6H4ClNO2Molecular Weight: 157.554460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: ZLKMOIHCHCMSFW-UHFFFAOYSA-N

• (2r)-2-Amino-1-Propanol
IUPAC Name: 2-aminopropan-1-ol | CAS Registry Number: 35320-23-1
Synonyms: Alaninol, d-Alaninol, 2-Aminopropanol, 2-Amino-1-propanol, DL-Alaninol, beta-Propanolamine, 1-Propanol, 2-amino-, D,L-Alaninol, .beta.-Propanolamine, 2-Aminopropan-1-ol, 2-Amino-2-methylethanol, 1-Hydroxy-2-aminopropane, 1-Methyl-2-hydroxyethylamine, ()-2-Amino-1-propanol, (+)-2-Aminopropan-1-ol, (R)-(-)-2-Amino-1-propanol, 1-Propanol, 2-amino-, DL-, 1-Propanol, 2-amino-, (S)-, 192171_ALDRICH, ARK011

Molecular Formula: C3H9NOMolecular Weight: 75.109660 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: BKMMTJMQCTUHRP-UHFFFAOYSA-N

• 3-Mercaptopropyltriethoxysilane
IUPAC Name: 3-triethoxysilylpropane-1-thiol | CAS Registry Number: 14814-09-6
Synonyms: 3-(Triethoxysilyl)propanethiol, (3-Mercaptopropyl)triethoxysilane, 63797_ALDRICH, Triethoxy(3-mercaptopropyl)silane, KH 590, 3-(Triethoxysilyl)propyl mercaptan, 3-Triethoxysilyl-1-propanethiol, Propanethiol, 3-(triethoxysilyl)-, 63797_FLUKA, EINECS 238-883-1, (gamma-Mercaptopropyl)triethoxysilane, MolPort-003-938-034, Silane, (3-mercaptopropyl)triethoxy-, 1-Propanethiol, 3-(triethoxysilyl)-, CID84658, BRN 2039575, BBV-213173, LS-121066, M1505, 133404-71-4

Molecular Formula: C9H22O3SSiMolecular Weight: 238.419680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: DCQBZYNUSLHVJC-UHFFFAOYSA-N

• 1-8-Octanediol
IUPAC Name: octane-1,8-diol | CAS Registry Number: 629-41-4
Synonyms: 1,8-Octanediol, Octamethylene glycol, Octane-1,8-diol, Octan-1,8-diol, O3303_ALDRICH, 74840_FLUKA, CHEBI:44630, AIDS017557, AIDS-017557, CID69420, NSC81228, EINECS 211-090-8, ZINC01574321, TL8004325, C14218, O-1000, ODI

Molecular Formula: C8H18O2Molecular Weight: 146.227320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: OEIJHBUUFURJLI-UHFFFAOYSA-N

• 2-Chloro-3-Cyanopyridine
IUPAC Name: 2-chloropyridine-3-carbonitrile | CAS Registry Number: 6602-54-6
Synonyms: 2-Chloronicotinonitrile, 2-Chloronicotinoitrile, 3-Cyano-2-chloropyridine, 2-Chloro-3-cyano-pyridine, NCIOpen2_000476, 535338_ALDRICH, 2-Chloro-3-pyridinecarbonitrile, NSC73287, ZERO/005552, CID81079, EINECS 229-550-1, ZINC00091827, NCI60_041599, TL806172

Molecular Formula: C6H3ClN2Molecular Weight: 138.554420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: JAUPUQRPBNDMDT-UHFFFAOYSA-N

• 4-Amino-1,2,4-Triazole
IUPAC Name: 1,2,4-triazol-4-amine | CAS Registry Number: 584-13-4
Synonyms: 4-Amino-1,2,4-triazole, 4H-1,2,4-Triazol-4-amine, 1-Amino-1,3,4-triazole, 4-Amino-4H-1,2,4-triazole, 1-Amino-1H-1,3,4-triazole, 4-Amino-1,2,4(4H)-triazole, A81803_ALDRICH, 4H-1,2,4-Triazol-4-ylamine, 4H-1,2,4-TRIAZOLE, 4-AMINO-, NSC 3263, NSC 7242, 09550_FLUKA, EINECS 209-533-5, NSC3263, NSC7242, AIDS074825, AIDS-074825, BRN 0107563, SBB004399, ZINC04692512

Molecular Formula: C2H4N4Molecular Weight: 84.079960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: FMCUPJKTGNBGEC-UHFFFAOYSA-N

• 2,3-Dichloropyridine
IUPAC Name: 2,3-dichloropyridine | CAS Registry Number: 2402-77-9
Synonyms: 2,3-DICHLOROPYRIDINE, Pyridine, 2,3-dichloro-, WLN: T6NJ BG CG, CCRIS 1726, D73405_ALDRICH, PYRIDINE,2,3-DICHLORO, EINECS 219-281-8, NSC 298535, BRN 0109811, NSC298535, ZINC00333069, D209, LS-131361, PB278179258, 5-20-05-00415 (Beilstein Handbook Reference), AF-834/25002667, InChI=1/C5H3Cl2N/c6-4-2-1-3-8-5(4)7/h1-3

Molecular Formula: C5H3Cl2NMolecular Weight: 147.990020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: MAKFMOSBBNKPMS-UHFFFAOYSA-N

• (R)-2-Hydroxy-4-phenylbutyric acid
IUPAC Name: (2R)-2-hydroxy-4-phenylbutanoic acid | CAS Registry Number: 267013-77-4
Synonyms: 29678-81-7, (R)-(-)-2-Hydroxy-4-phenylbutyric acid, (2R)-2-hydroxy-4-phenylbutanoic acid, (R)-2-Hydroxy-4-phenylbutanoicAcid, (R)-2-hydroxy-4-phenylbutanoic acid, PubChem5687, SureCN233440, AC1MC05S, 420085_ALDRICH, AC1Q59Q5, Jsp005621, CTK4F8369, MolPort-001-794-060, ANW-26676, (r)-2-hydroxy-4-phenyl-butyric acid, AKOS015855449, AC-6643, R-(-)-2-Hydroxy-4-phenylbutyric acid, AK-34569, BR-34569

Molecular Formula: C10H12O3Molecular Weight: 180.200480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: JNJCEALGCZSIGB-SECBINFHSA-N

• (R)-(-)-Epichlorohydrin
IUPAC Name: 2-(chloromethyl)oxirane | CAS Registry Number: 51594-55-9
Synonyms: EPICHLOROHYDRIN, Epichlorhydrin, Glycidyl chloride, Epichlorophydrin, 2-(Chloromethyl)oxirane, Chloromethyloxirane, epi-Chlorohydrin, alpha-Epichlorohydrin, Chloropropylene oxide, Chloropropylene, Epichlorhydrine, Epicloridrina, Chloromethyl, Oxirane, (chloromethyl)-, Polidexide, SKEKhG, Epichloorhydrine, Epichlorohydryna, 1-Chloro-2,3-epoxypropane, Glycerol epichlorohydrin

Molecular Formula: C3H5ClOMolecular Weight: 92.524200 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: BRLQWZUYTZBJKN-UHFFFAOYSA-N

• 4-Methoxypyridine
IUPAC Name: 4-methoxypyridine | CAS Registry Number: 620-08-6
Synonyms: Pyridine, 4-methoxy-, .gamma.-Methoxypyridine, Ambap3937, methyl pyridin-4-yl ether, 460621_ALDRICH, EINECS 210-624-7, ZINC00330918, M113, TL8004012, AC-907/25004551, InChI=1/C6H7NO/c1-8-6-2-4-7-5-3-6/h2-5H,1H

Molecular Formula: C6H7NOMolecular Weight: 109.125880 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: XQABVLBGNWBWIV-UHFFFAOYSA-N

• (S)-(+)-Epichlorohydrin
IUPAC Name: (2S)-2-(chloromethyl)oxirane | CAS Registry Number: 67843-74-7
Synonyms: (S)-Epichlorohydrin, (S)-(Chloromethyl)oxirane, 2-(Chloromethyl)oxirane, (S)-()-Epichlorohydrin, CCRIS 6388, oxirane, 2-(chloromethyl)-, (2S)-2-(chloromethyl)oxirane, 540080_ALDRICH, Oxirane, (chloromethyl)-, (S)-, 45327_FLUKA, CHEBI:37145, (S)-()-2-(Chloromethyl)oxirane, BRN 1420784, ZINC01487602, SB 02049, LS-101031, TL8004778, 5-17-01-00021 (Beilstein Handbook Reference), InChI=1/C3H5ClO/c4-1-3-2-5-3/h3H,1-2H, 106-89-8

Molecular Formula: C3H5ClOMolecular Weight: 92.524200 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: BRLQWZUYTZBJKN-GSVOUGTGSA-N

• 2-(4-Methoxyphenyl)-2-(1-hydroxycyclohexyl)ethylamine hydrochloride
IUPAC Name: 1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexan-1-ol | CAS Registry Number: 93413-77-5
Synonyms: Dinorvenlafaxine, 1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol, 1-(2-amino-1-(4-methoxyphenyl)ethyl)cyclohexanol, 1-(2-Amino-1-(p-methoxyphenyl)ethyl)cyclohexanol, 1-[2-Amino-1-(p-methoxyphenyl)ethyl]cyclohexanol, N,N-Didesmethylvenlafaxine, SureCN637250, CHEMBL98158, UNII-3235EO37UJ, D,L-N,N-Didesmethylvenlafaxine, CTK7E2043, D,L-N,N-Didesmethyl Venlafaxine, CHEBI:261155, MolPort-003-846-639, AKOS015994493, N,N-Didesmethylvenlafaxine, (+/-)-, AG-C-20042, AG-H-81880, MCULE-7209143972, SS-3413

Molecular Formula: C15H23NO2Molecular Weight: 249.348620 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: SUQHIQRIIBKNOR-UHFFFAOYSA-N

• 2-Adamantanone
IUPAC Name: adamantan-2-one | CAS Registry Number: 700-58-3
Synonyms: Adamantanone, 2-Oxoadamantane, 2-Adamantone, Adamantan-2-one, 146048_ALDRICH, 429783_ALDRICH, 01825_FLUKA, CHEBI:40611, EINECS 211-847-2, CPD-743, Tricyclo[3.3.1.1(3,7)]decanone, NSC 126345, Tricyclo(3.3.1.13,7)decanone, Tricyclo[3.3.1.13,7]decanone, Tricyclo(3.3.1.13,7)decan-2-one, BRN 1210235, tricyclo[3.3.13,7]decan-2-one, c0604, NSC126345, SBB015156

Molecular Formula: C10H14OMolecular Weight: 150.217560 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: IYKFYARMMIESOX-UHFFFAOYSA-N

• 4-Bromo Benzyl Cyanide
IUPAC Name: 2-(4-bromophenyl)acetonitrile | CAS Registry Number: 16532-79-9
Synonyms: p-Bromobenzylcyanide, 4-Bromobenzylcyanide, p-Bromobenzyl cyanide, 4-Bromophenylacetonitrile, p-Bromophenylacetonitrile, 4-Bromobenzyl cyanide, 4-Bromobenzeneacetonitrile, Benzeneacetonitrile, 4-bromo-, 2-(4-Bromophenyl)acetonitrile, WLN: NC1R DE, (4-bromophenyl)acetonitrile, ACETONITRILE, (p-BROMOPHENYL)-, 124664_ALDRICH, EINECS 240-602-2, NSC 84174, NSC84174, BRN 1861069, ZINC00164864, LS-13221, ST5406219

Molecular Formula: C8H6BrNMolecular Weight: 196.043940 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: MFHFWRBXPQDZSA-UHFFFAOYSA-N

• (+/-)-trans-4-(Fluorophenyl)-3-hydroxymethyl-1-methylpiperidine
IUPAC Name: [4-(4-fluorophenyl)-1-methylpiperidin-3-yl]methanol | CAS Registry Number: 109887-53-8
Synonyms: 4-(4-Fluorophenyl)-3-hydroxymethyl-1-methyl-piperidine, AG-D-26933, 4-(4-Fluorophenyl)-3-hydroxymethyl-1-methylpiperidine, trans-4-(4-Fluorophenyl)-3-hydroxymethyl-1-methylpiperidine, Trans-4-(4-Fluorophenyl)-3-hydroxymethyl-1-methyl-piperidine, PubChem15203, ACMC-20m3dp, ACMC-1BSBV, ACMC-20a15g, SureCN1944024, KSC497G2N, AGN-PC-00N9Z3, 3-Piperidinemethanol, 4-(4-fluorophenyl)-1-methyl-, (3R,4R)-, CTK3J7326, MolPort-003-986-225, 100332-12-5, AC-449, AKOS005063663, MCULE-5497597796, RP27470

Molecular Formula: C13H18FNOMolecular Weight: 223.286523 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: CXRHUYYZISIIMT-UHFFFAOYSA-N

• (R)-3-Aminopyrrolidine
IUPAC Name: (3R)-pyrrolidin-3-amine | CAS Registry Number: 116183-82-5
Synonyms: (R)-pyrrolidin-3-amine, (3R)-(+)-3-Aminopyrrolidine, (3S)-Pyrrolidinamine, (R)-(+)-3-Aminopyrrolidine, AG-D-37492, (R)-3-Aminopyrrolidine dihydrochloride, PubChem5728, (3R)-pyrrolidin-3-amine, SureCN242920, AC1LU30J, 540781_ALDRICH, CTK3J4348, MolPort-000-000-472, ANW-16944, AKOS015854027, AC-13107, AK-80471, BP-12311, BR-80471, KB-03189

Molecular Formula: C4H10N2Molecular Weight: 86.135600 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: NGXSWUFDCSEIOO-SCSAIBSYSA-N

• 5-Chloro-2-nitrobenzotrifluoride
IUPAC Name: 4-chloro-1-nitro-2-(trifluoromethyl)benzene | CAS Registry Number: 118-83-2
Synonyms: C60805_ALDRICH, EINECS 204-280-7, SBB009905, ZINC00057136, 4-Chloro-1-nitro-2-(trifluoromethyl)benzene, Benzene, 4-chloro-1-nitro-2-(trifluoromethyl)-, 5-Chloro-2-nitro-alpha,alpha,alpha-trifluorotoluene, 5-Chloro-alpha,alpha,alpha-trifluoro-2-nitrotoluene, T5652305

Molecular Formula: C7H3ClF3NO2Molecular Weight: 225.552430 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: CFPIGEXZPWTNOR-UHFFFAOYSA-N

• (S)-3-Aminoquinuclidine hydrochloride
IUPAC Name: (3S)-1-azabicyclo[2.2.2]octan-3-amine;dihydrochloride | CAS Registry Number: 119904-90-4
Synonyms: (S)-3-Aminoquinuclidine dihydrochloride, (S)-(-)-3-Aminoquinuclidine dihydrochloride, SureCN222751, KSC498E6T, 415723_ALDRICH, CTK3J8269, MolPort-001-769-431, MolPort-016-582-186, ACT02255, ANW-52491, OR6142, RW2223, (S)-(-)-3-Aminoquinuclidine 2HCl, (S)-3-AMINOQUINUCLIDINE 2HCL, AKOS015897102, AC-1559, AG-B-75156, (S)-Quinuclidin-3-amine dihydrochloride, AK-32971, BR-32971

Molecular Formula: C7H16Cl2N2Molecular Weight: 199.121340 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 2

InChIKey: STZHBULOYDCZET-XCUBXKJBSA-N

• 1,4-Benzodioxane-2-Carboxylic Acid
IUPAC Name: 2,3-dihydro-1,4-benzodioxine-3-carboxylic acid | CAS Registry Number: 34385-93-8
Synonyms: 1,4-Benzodioxan-2-carboxylic acid, 3663-80-7, 1,4-Benzodioxane-2-carboxylic Acid, 2,3-dihydro-1,4-benzodioxine-2-carboxylic acid, 1,4-Benzodioxan-2-carboxylicacid, 2,3-Dihydro-benzo[1,4]dioxine-2-carboxylic acid, 2H,3H-benzo[e]1,4-dioxane-2-carboxylic acid, CDS1_000297, ACMC-1CUSQ, Maybridge1_002585, ChemDiv2_003276, SureCN229498, AC1MC3C7, UNII-T9Z56HV1B0, Oprea1_073520, KSC222G6B, DivK1c_001337, 561371_ALDRICH, AC1Q74Q6, BEN022

Molecular Formula: C9H8O4Molecular Weight: 180.157420 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: HMBHAQMOBKLWRX-UHFFFAOYSA-N

• 2,5-Dibromo-3-methylpyridine
IUPAC Name: 2,5-dibromo-3-methylpyridine | CAS Registry Number: 3430-18-0
Synonyms: 2,5-Dibromo-3-picoline, 637661_ALDRICH, 652865_ALDRICH, ZINC00331806, CID817680, SBB003143, TL8002556, AC-907/30003010

Molecular Formula: C6H5Br2NMolecular Weight: 250.918600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: LIMXEVCFAUTBCK-UHFFFAOYSA-N

• 4-Pipecoline
IUPAC Name: 4-methylpiperidine | CAS Registry Number: 626-58-4
Synonyms: 4-Methylpiperidine, gamma-Pipecoline, Piperidine, 4-methyl-, .gamma.-Pipecoline, 4-Pipecoline (8CI), M73206_ALDRICH, NSC66495, EINECS 210-954-1, NSC 66495, AI3-52235, ST5213821, TL8004227, InChI=1/C6H13N/c1-6-2-4-7-5-3-6/h6-7H,2-5H2,1H

Molecular Formula: C6H13NMolecular Weight: 99.174120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: UZOFELREXGAFOI-UHFFFAOYSA-N

• (R)-2-Tetrahydrofuroic acid
IUPAC Name: (2R)-oxolane-2-carboxylic acid | CAS Registry Number: 87392-05-0
Synonyms: (R)-(+)-2-Tetrahydrofuroic acid, (R)-(+)-Tetrahydro-2-furoic acid, (R)-(+)-Tetrahydrofuran-2-carboxylic Acid, (2R)-oxolane-2-carboxylic acid, D-Tetrahydro-furan-2-carboxylic acid, (r)-tetrahydro-2-furoic acid, 2-Furancarboxylic acid, tetrahydro-, (2R)-, (r)-tetrahydrofuran-2-carboxylic acid, AG-H-52598, (S)-2-Tetrahydrofuroic acid, r-thfc, TETRAHYDROFURAN-2-CARBOXYLIC ACID, PubChem5796, AC1MC1QW, SureCN353229, r-tetrahydro-2-furoic acid, AC1Q71DT, AC1Q71DU, (r)-2-tetrahydrofuroic acid, KSC448A3B

Molecular Formula: C5H8O3Molecular Weight: 116.115220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: UJJLJRQIPMGXEZ-SCSAIBSYSA-N

• 2-Methoxy-6-methylaminopyridine
IUPAC Name: 6-methoxy-N-methylpyridin-2-amine | CAS Registry Number: 88569-83-9
Synonyms: Ambap2289, 2-Methoxy-6-(methylamino)pyridine, M131, TL806337

Molecular Formula: C7H10N2OMolecular Weight: 138.167100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: GXHQLRBOZRJHPZ-UHFFFAOYSA-N

• 1-Bromo-3,5-dimethyladamantane
IUPAC Name: 1-bromo-3,5-dimethyladamantane | CAS Registry Number: 941-37-7
Synonyms: NCIOpen2_006758, 187844_ALDRICH, EINECS 213-378-9, NSC102293, ST5410687, 1-Bromo-3,5-dimethyltricyclo(3.3.1.13,7)decane, Tricyclo[3.3.1.1(3,7)-]decane, 1-bromo-3,5-dimethyl-

Molecular Formula: C12H19BrMolecular Weight: 243.183260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: QUCXLVDIVQWYJR-UHFFFAOYSA-N

• (S)(-) Alpha Methyl Benzyl Amine
IUPAC Name: (1S)-1-phenylethanamine | CAS Registry Number: 2627-86-3
Synonyms: L-alpha-Methylbenzylamine, (-)-alpha-Phenethylamine, (1S)-1-phenylethanamine, L-(-)-1-Phenylethylamine, ALPHA-METHYLBENZYLAMINE, L(-)-alpha-Methylbenzylamine, L-(-)-alpha-Phenylethylamine, (S)-alpha-Methylbenzenemethanamine, 115568_ALDRICH, 77869_FLUKA, 77870_FLUKA, CHEBI:35321, (S)-(-)-alpha-Methylbenzylamine, EINECS 220-098-0, (alphaS)-alpha-methylbenzenemethanamine, (S)-(−)-1-Phenylethylamine, SL-00444, (S)-(−)-alpha-Methylbenzylamine, Benzenemethanamine, alpha-methyl-, (alphaS)-, 137577-63-0

Molecular Formula: C8H11NMolecular Weight: 121.179640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: RQEUFEKYXDPUSK-ZETCQYMHSA-N

• 2-Methoxy-6-methylpyridine
IUPAC Name: 2-methoxy-6-methylpyridine | CAS Registry Number: 63071-03-4
Synonyms: M139, InChI=1/C7H9NO/c1-6-4-3-5-7(8-6)9-2/h3-5H,1-2H

Molecular Formula: C7H9NOMolecular Weight: 123.152460 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: WIMNZMOEBDPZTB-UHFFFAOYSA-N

• 2-Mercapto-4,6-Dimethyl Pyrimidine
IUPAC Name: 4,6-dimethyl-1H-pyrimidine-2-thione | CAS Registry Number: 22325-27-5
Synonyms: 4,6-Dimethyl-2-mercaptopyrimidine, 4,6-Dimethyl-2-pyrimidinethiol, 4,6-Dimethyl-2-thiopyrimidine, 4,6-Dimethylpyrimidine-2-thione, 138010_ALDRICH, 2-Mercapto-4,6-dimethylpyrimidine, 2(1H)-Pyrimidinethione, 4,6-dimethyl-, EINECS 244-911-3, 2-Pyrimidinethiol, 4,6-dimethyl-, 4,6-Dimethyl-2(1H)-pyrimidinethione, NSC15491, 2-Mercapto-4,6-dimethyl-pyrimidine, ZINC00035775, ZINC00086626, LS-135636, A0458/0021138, 13139-97-4

Molecular Formula: C6H8N2SMolecular Weight: 140.206120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 0

InChIKey: RAFAYWADRVMWFA-UHFFFAOYSA-N

• 2,3-Dichloro-5,6-Dicyano-1,4-Benzoquinone
IUPAC Name: 4,5-dichloro-3,6-dioxocyclohexa-1,4-diene-1,2-dicarbonitrile | CAS Registry Number: 84-58-2
Synonyms: Dichlorodicyanoquinone, Dichlorodicyano-p-benzoquinone, Dichlorodicyanobenzoquinone, 2,3-Dichloro-5,6-dicyanoquinone, CCRIS 7154, D60400_ALDRICH, 1,2-Dichloro-4,5-dicyanobenzoquinone, 2,3-Dichloro-5,6-dicyanobenzoquinone, 2,3-Dicyano-5,6-dichlorobenzoquinone, 2,3,5,6-Dichlorodicyanoquinone, EINECS 201-542-2, 2,3-Dichloro-5,6-dicyano-p-quinone, AIDS218263, 2,3-Dichloro-5,6-dicyano-p-benzoquinone, NSC 401087, AIDS-218263, NSC401087, 5,6-Dichloro-2,3-dicyano-p-benzoquinone, 5,6-Dicyano-2,3-dichloro-p-benzoquinone, 1,4-CYCLOHEXADIENE-1,2-DICARBONITRILE, 4,5-DICHLORO-3,6-DIOXO-

Molecular Formula: C8Cl2N2O2Molecular Weight: 227.003800 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: HZNVUJQVZSTENZ-UHFFFAOYSA-N

• 2-Amino-5-Chloro Pyridine
IUPAC Name: 5-chloropyridin-2-amine | CAS Registry Number: 1072-98-6
Synonyms: 2-Amino-5-chloropyridine, 5-Chloro-2-pyridinamine, 2-Pyridinamine, 5-chloro-, 5-Chloro-2-pyridylamine, 5-Chloro-2-aminopyridine, A46803_ALDRICH, Pyridine, 2-amino-5-chloro-, 07530_FLUKA, AIDS021202, AIDS-021202, NSC26283, EINECS 214-020-4, SBB000059, A114, AI3-52448, TL800742115, AH-034/32826050, InChI=1/C5H5ClN2/c6-4-1-2-5(7)8-3-4/h1-3H,(H2,7,8

Molecular Formula: C5H5ClN2Molecular Weight: 128.559600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: MAXBVGJEFDMHNV-UHFFFAOYSA-N

• 3,3-Dimethyl acrylic Acid Methyl ester
IUPAC Name: methyl 3-methylbut-2-enoate | CAS Registry Number: 924-50-5
Synonyms: Methyl 3-methyl-2-butenoate, METHYL DIMETHYL ACRYLATE, Methyl 3,3-dimethylacrylate, ghl.PD_Mitscher_leg0.193, 368571_ALDRICH, 38890_FLUKA, CID13546, 2-Butenoic acid, 3-methyl-, methyl ester, EINECS 213-107-4, Crotonic acid, 3-methyl-, methyl ester, ZINC00388580, InChI=1/C6H10O2/c1-5(2)4-6(7)8-3/h4H,1-3H

Molecular Formula: C6H10O2Molecular Weight: 114.142400 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: FZIBCCGGICGWBP-UHFFFAOYSA-N

• 4-Hydroxy Carbazole
IUPAC Name: 9H-carbazol-4-ol | CAS Registry Number: 52602-39-8
Synonyms: 4-Hydroxycarbazole, 9H-Carbazol-4-ol, CCRIS 5300, 543896_ALDRICH, EINECS 258-034-9, ZINC02391423, KS-1022, LS-188614, TL8003461

Molecular Formula: C12H9NOMolecular Weight: 183.205960 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: UEOHATPGKDSULR-UHFFFAOYSA-N

• (R)-(+)-Methyl P-Tolyl Sulfoxide
IUPAC Name: 1-methyl-4-[(R)-methylsulfinyl]benzene | CAS Registry Number: 1519-39-7
Synonyms: (R)-(+)-Methyl p-tolyl sulfoxide, (R)-METHYL P-TOLYLSULFOXIDE, AB-131/40227926, SureCN1094237, (R)-methylp-tolyl sulfoxide, 343609_ALDRICH, CTK8C6307, MolPort-003-800-344, 4-methyl-1-(methylsulfinyl)benzene, SBB087034, ZINC06144145, AKOS015890843, KB-03396, N143, I01-7614

Molecular Formula: C8H10OSMolecular Weight: 154.229400 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: FEVALTJSQBFLEU-SNVBAGLBSA-N

• 1-(3-Chloropropoxy)-4-Fluorobenzene
IUPAC Name: 1-(3-chloropropoxy)-4-fluorobenzene | CAS Registry Number: 1716-42-3
Synonyms: ZINC01995200, CID74391, EINECS 217-000-3, SBB003674, 1-(3-Chloropropoxy)-4-fluorobenzene

Molecular Formula: C9H10ClFOMolecular Weight: 188.626503 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: DFFWYMMOMUTKOI-UHFFFAOYSA-N

• 2-Cyano-4'-Methylbiphenyl
IUPAC Name: 2-(4-methylphenyl)benzonitrile | CAS Registry Number: 114772-53-1
Synonyms: 2-Cyano-4'-methylbiphenyl, 459569_ALDRICH, Benzonitrile, 2-(4-methylphenyl)-, 4'-Methyl-2-biphenylcarbonitrile, BM192, ZINC01256886, 4'-Methyl[1,1'-biphenyl]-2-carbonitrile, TL8000424, 7J-918, InChI=1/C14H11N/c1-11-6-8-12(9-7-11)14-5-3-2-4-13(14)10-15/h2-9H,1H

Molecular Formula: C14H11NMolecular Weight: 193.243840 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: ZGQVZLSNEBEHFN-UHFFFAOYSA-N

• 4-Hydroxypropiophenone
IUPAC Name: 1-(4-hydroxyphenyl)propan-1-one | CAS Registry Number: 70-70-2
Synonyms: Paroxypropione, Paroxypropion, Proxiphenon, Frenantol, Frenohypon, Frenormon, Hypophenon, Possipione, Profenone, Sterofenon, Hypostat, Ibiopopp, Paroxon, Frenon, Mepal, p-Propiophenol, Bio-fren, p-Propionylphenol, p-Oxypropiophenone, 4-Propionylphenol

Molecular Formula: C9H10O2Molecular Weight: 150.174500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: RARSHUDCJQSEFJ-UHFFFAOYSA-N

• 3-Glycidoxypropyltrimethoxysilane
IUPAC Name: trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane | CAS Registry Number: 2530-83-8
Synonyms: Glymo, Silicone KBM 403, Silane A 187, Silicone A-187, Union carbide A-187, Silane Z 6040, Silane-Y-4087, Silan A 187, Silicone A 187, Glycidyloxypropyltrimethoxysilane, NUCA 187, KBM 403, KBM 430, CCRIS 3044, (3-Glycidoxypropyl)trimethoxysilane, Glycidoxypropyltrimethoxysilane, Dow Corning product Z-6040, 440167_ALDRICH, Glycidyl 3-(trimethoxysilyl)propyl ether, gamma-Glycidoxypropyltrimethoxysilane

Molecular Formula: C9H20O5SiMolecular Weight: 236.337600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: BPSIOYPQMFLKFR-UHFFFAOYSA-N

• 4-Hydroxypiperidine
IUPAC Name: piperidin-4-ol | CAS Registry Number: 5382-16-1
Synonyms: 4-Piperidinol, Piperidin-4-ol, 128775_ALDRICH, NSC62083, 56220_FLUKA, BB_SC-2766, CID79341, EINECS 226-373-1, NSC 62083, TL806407, AI3-39158

Molecular Formula: C5H11NOMolecular Weight: 101.146940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: HDOWRFHMPULYOA-UHFFFAOYSA-N

• 2 2-Azobis-Isobutryonitrile
IUPAC Name: 2-(2-cyanopropan-2-yldiazenyl)-2-methylpropanenitrile | CAS Registry Number: 78-67-1
Synonyms: Genitron, Aivn, Azdh, Vazo, Pianofor an, Porophor N, Porofor N, Aceto AZIB, AIBN, Porofor 57, Azobisisobutylonitrile, Azobisisobutyronitrile, Poly-Zole AZDN, Chkhz 57, Azobis(isobutyronitrile), Azodi(isobutyronitrile), 2,2-Azodiisobutyronitrile, VAZO 64, 2,2'-Azodiisobutyronitrile, 2,2'-Azobisisobutyronitrile

Molecular Formula: C8H12N4Molecular Weight: 164.207680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: OZAIFHULBGXAKX-UHFFFAOYSA-N

• 2-Pyridinol
IUPAC Name: 1H-pyridin-2-one | CAS Registry Number: 142-08-5
Synonyms: 2-Pyridone, 2-HYDROXYPYRIDINE, 2(1H)-Pyridinone, 2-Oxopyridine, 2-Pyridinone, alpha-Pyridone, Pyridin-2-ol, 2(1H)-Pyridone, .alpha.-Pyridone, Pyridinol, 2(lH)-Pyridinone, Pyridone-2 [French], pyridin-2(1H)-one, H56800_ALDRICH, 56380_FLUKA, CHEBI:16540, EINECS 205-520-3, NSC172522, AIDS081857, AIDS167209

Molecular Formula: C5H5NOMolecular Weight: 95.099300 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: UBQKCCHYAOITMY-UHFFFAOYSA-N

• 3-Indole Acetic Acid
IUPAC Name: 2-(1H-indol-3-yl)acetic acid | CAS Registry Number: 87-51-4
Synonyms: indoleacetic acid, Heteroauxin, Rhizopin, 3-Indoleacetic acid, auxin, indole-3-acetic acid, indoleacetate, Hexteroauxin, Rhizopon A, 1H-Indole-3-acetic acid, indole-3-acetate, Acetic acid, indolyl-, 3-Iaa, beta-Indoleacetic acid, 3-(Carboxymethyl)indole, Heteroauxinhexteroauxiniaa, alpha-IAA, beta-Indolylacetic acid, Indol-3-ylacetic acid, beta-IAA

Molecular Formula: C10H9NO2Molecular Weight: 175.183960 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: SEOVTRFCIGRIMH-UHFFFAOYSA-N

• (S)-(-)-1,1'-Bi(2-naphthol),[(S)-BINOL]
IUPAC Name: 1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol | CAS Registry Number: 18531-99-2
Synonyms: 1,1'-Bi-2-naphthol, (S)-(-)-1,1'-Bi-2-naphthol, 18531-94-7, 602-09-5, 2,2'-Dinaphthol, binol, (R)-(+)-1,1'-Bi-2-naphthol, beta-Binaphthol, 1,1'-Binaphthyl-2,2'-diol, (S)-BINOL, (R)-1,1'-Bi-2-naphthol, 1,1'-Bis-2-naphthol, 2,2'-Dihydroxydinaphthyl, Chiral binaphthol, 2,2'-Dihydroxy-1,1'-binaphthyl, 2,2'-Dihydroxy-1,1'-dinaphthyl, Bis-beta-naphthol, 2,2'-Dihydroxybinaphthalene, s-(-)-1,1'-bi-2-naphthol, [1,1'-Binaphthalene]-2,2'-diol

Molecular Formula: C20H14O2Molecular Weight: 286.323960 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: PPTXVXKCQZKFBN-UHFFFAOYSA-N

• 6-Dehydroprogesterone
IUPAC Name: (8S,9S,10R,13S,14S,17S)-17-acetyl-10,13-dimethyl-1,2,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-one | CAS Registry Number: 1162-56-7
Synonyms: dydrogesterone, Pregna-4,6-diene-3,20-dione, CID101994

Molecular Formula: C21H28O2Molecular Weight: 312.445820 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: JGMOKGBVKVMRFX-LEKSSAKUSA-N

• 2-Propoxybenzoic acid
IUPAC Name: 2-propoxybenzoate | CAS Registry Number: 2100-31-4
Synonyms: ZINC02572613, CID7021529

Molecular Formula: C10H11O3-Molecular Weight: 179.192540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: OXOWWPXTTOCKKU-UHFFFAOYSA-M

• 5,6-Dimethoxy-1-Indanone
IUPAC Name: 5,6-dimethoxy-2,3-dihydroinden-1-one | CAS Registry Number: 2107-69-9
Synonyms: 5,6-Dimethoxy-1-indanone, 5,6-Dimethoxyindan-1-one, 147826_ALDRICH, NSC401450, CID75018, EINECS 218-287-8, ZINC00164394, NSC 401450, 1H-Inden-1-one, 2,3-dihydro-5,6-dimethoxy-, ST5308464, TL8001751, InChI=1/C11H12O3/c1-13-10-5-7-3-4-9(12)8(7)6-11(10)14-2/h5-6H,3-4H2,1-2H

Molecular Formula: C11H12O3Molecular Weight: 192.211180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: IHMQOBPGHZFGLC-UHFFFAOYSA-N

• 3-glycidoxypropyltriethoxysilane
IUPAC Name: triethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane | CAS Registry Number: 2602-34-8
Synonyms: CCRIS 3046, gamma-Glycidoxypropyltriethoxysilane, 50059_FLUKA, EINECS 220-011-6, (3-Glycidyloxypropyl)triethoxysilane, (3-(2,3-Epoxypropoxy)propyl)triethoxysilane, LS-194113, LS-194256, LS-194909, 3-(2,3-Epoxypropyloxy)propyltriethoxysilane, 6688-70-6

Molecular Formula: C12H26O5SiMolecular Weight: 278.417340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: JXUKBNICSRJFAP-UHFFFAOYSA-N

• 1,3-Dihydroxyadamantane
IUPAC Name: adamantane-1,3-diol | CAS Registry Number: 5001-18-3
Synonyms: 1,3-Adamantanediol, Adamantane-1,3-diol, ADAMANTANEDIOL, tricyclo[3.3.1.1~3,7~]decane-1,3-diol, 1,3-Adamantandiol, ZINC00162333, PubChem8786, PubChem9743, AC1LCBVR, 1,3-Dihydroxyadamanatane, 1,3-Dihydroxyadamantane., ACMC-1AQ0N, SureCN424418, AC1Q79EG, Oprea1_509718, KSC174M5D, 93749_ALDRICH, Ambap5001-18-3, 93749_FLUKA, CTK0H4651

Molecular Formula: C10H16O2Molecular Weight: 168.232840 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: MOLCWHCSXCKHAP-UHFFFAOYSA-N

• 5-Methoxy-2-[(4-Methoxy-3, 5-Dimethyl-2-Pyridinyl)-Methylthio-1h-Benzimidazole
IUPAC Name: 6-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfanyl]-1H-benzimidazole | CAS Registry Number: 73590-85-9
Synonyms: Omeprazole sulfide, Ufiprazole [INN], Ufiprazol [Spanish], Ufiprazolum [Latin], CID155794, 5-Methoxy-2-(((4-methoxy-3,5-dimethyl-2-pyridyl)methyl)thio)benzimidazol, 5-Methoxy-2-(((4-methoxy-3,5-dimethyl-2-pyridyl)methyl)thio)benzimidazole, 1H-Benzimidazole, 5-methoxy-2-(((4-methoxy-3,5-dimethyl-2-pyridinyl)methyl)thio)-

Molecular Formula: C17H19N3O2SMolecular Weight: 329.416660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: XURCIPRUUASYLR-UHFFFAOYSA-N


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