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• 4-(hydroxymethyl)-2-methylbenzoic acid

IUPAC Name: 4-(hydroxymethyl)-2-methylbenzoic acid | CAS Registry Number: 861555-67-1
Synonyms: SCHEMBL1627397, GAXTYDGCLIEMIG-UHFFFAOYSA-N, methyl 4-(hydroxymethyl)benzoic acid

Molecular Formula:	C₉H₁₀O₃	Molecular Weight:	166.176 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: GAXTYDGCLIEMIG-UHFFFAOYSA-N

• 6-Bromo-1H-pyrazolo[3,4-b]pyridine

IUPAC Name: 6-bromo-1H-pyrazolo[3,4-b]pyridine | CAS Registry Number: 934560-92-6
Synonyms: CTK8C3074, MolPort-022-450-229, ANW-69634, AKOS016006353, AB66635, AK104060, KB-44748, Y5665, 1H-PYRAZOLO[3,4-B]PYRIDINE, 6-BROMO-

Molecular Formula:	C₆H₄BrN₃	Molecular Weight:	198.020060 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: GRLXWXRTASHOBS-UHFFFAOYSA-N

• 2-Bromo-1-(3-Thienyl)-1-Ethanone

IUPAC Name: 2-bromo-1-thiophen-3-ylethanone | CAS Registry Number: 1468-82-2
Synonyms: ZINC00158757, CID2776379, 10X-0708

Molecular Formula:	C₆H₅BrOS	Molecular Weight:	205.072300 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: TXEJYUFJFSPCHH-UHFFFAOYSA-N

• 6-Chloro-2-fluoropurine

IUPAC Name: 6-chloro-2-fluoro-7H-purine | CAS Registry Number: 1651-29-2
Synonyms: 1jdj, nchembio.87-comp26, 2-Fluoro-6-chloropurine, 6-Chloro-2-fluoro-9H-purine, 6-CHLORO-2-FLUOROPURINE, NSC37363, ZINC04242552, CID5287914, TL8001267, CFP

Molecular Formula:	C₅H₂ClFN₄	Molecular Weight:	172.547583 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: UNRIYCIDCQDGQE-UHFFFAOYSA-N

• 2-Carbethoxy-4-benzyloxyindole

IUPAC Name: ethyl 4-(phenylmethoxy)-1H-indole-2-carboxylate | CAS Registry Number: 27737-55-9
Synonyms: ZINC02566040, EINECS 248-627-0, CID119707, B-1995, Ethyl 4-(phenylmethoxy)-1H-indole-2-carboxylate

Molecular Formula:	C₁₈H₁₇NO₃	Molecular Weight:	295.332480 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: HIQPISGKBJHKIN-UHFFFAOYSA-N

• 5-Chloro-2-fluorophenylboronic acid

IUPAC Name: (5-chloro-2-fluorophenyl)boronic acid | CAS Registry Number: 352535-83-2
Synonyms: 557234_ALDRICH, C2202G1

Molecular Formula:	C₆H₅BClFO₂	Molecular Weight:	174.365103 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: GGTUVWGMCFXUAS-UHFFFAOYSA-N

• 1-Methyl-1H-pyrazole-4-methanamine hydrochloride

IUPAC Name: (1-methylpyrazol-4-yl)methanamine;hydrochloride | CAS Registry Number: 1107601-70-6
Synonyms: (1-methyl-1H-pyrazol-4-yl)methanamine hydrochloride, AC1Q3BN3, SureCN1690783, CTK8B5525, MolPort-008-478-109, ANW-49029, AKOS015920291, AM81127, QC-3000, AK-76415, BR-76415, KB-205202, X8957, EN300-73505, (1-methylpyrazol-4-yl)methanamine hydrochloride, (1-METHYL-1H-PYRAZOL-4-YL)METHANAMINE HCL, 1H-Pyrazole-4-methanamine, 1-methyl- hydrochloride, 1H-Pyrazole-4-methanamine, 1-methyl-, hydrochloride (1:1)

Molecular Formula:	C₅H₁₀ClN₃	Molecular Weight:	147.606000 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: IPJABYVHNXMKEV-UHFFFAOYSA-N

• 5-(tert-butoxycarbonyl)-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine-2-carboxylic acid

IUPAC Name: 5-[(2-methylpropan-2-yl)oxycarbonyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxylic acid | CAS Registry Number: 165948-21-0
Synonyms: PubChem23064, SureCN741444, AGN-PC-006SLJ, CTK7G2965, AKOS015838363, AG-A-81837, QC-4078, AK-49459, AB1000092, KB-244702, 5-boc-4,5,6,7-tetrahydro-1,3-thiazolo[5,4-c]pyridine-2-carboxylic acid, 5-[(2-methylpropan-2-yl)oxycarbonyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxylic acid

Molecular Formula:	C₁₂H₁₆N₂O₄S	Molecular Weight:	284.331440 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	6

InChIKey: LLPCRFYYYVEWMH-UHFFFAOYSA-N

• 3-bromoquinolin-6-yl acetate

IUPAC Name: (3-bromoquinolin-6-yl) acetate | CAS Registry Number: 1022151-47-8
Synonyms: 3-Bromoquinolin-6-yl acetate, 6-Acetoxy-3-bromoquinoline, SureCN3150403, CTK8C0504, ANW-64784, AKOS016005051, AK103452, KB-53264

Molecular Formula:	C₁₁H₈BrNO₂	Molecular Weight:	266.090720 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: ZXPMRDCMTBPCLA-UHFFFAOYSA-N

• 2-Chloro-5-iodo-7H-pyrrolo[2,3-d]pyrimidine

IUPAC Name: 2-chloro-5-iodo-7H-pyrrolo[2,3-d]pyrimidine | CAS Registry Number: 1060815-90-8
Synonyms: 2-chloro-5-iodo-7H-pyrrolo[2,3-d]pyrimidine, CTK4A4350, MolPort-019-878-970, ANW-51745, AKOS015850518, AG-L-20245, QC-3734, RP08676, AK-32014, BR-32014, AB1011674, KB-229860, AM20080009, FT-0684707, X8788, C-8626, A801383, 2-chloranyl-5-iodanyl-7H-pyrrolo[2,3-d]pyrimidine

Molecular Formula:	C₆H₃ClIN₃	Molecular Weight:	279.465590 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: CPGBAXNIILKLJF-UHFFFAOYSA-N

• 2-(Aminomethyl)-5-bromo-3-fluoropyridine hydrochloride

IUPAC Name: (5-bromo-3-fluoropyridin-2-yl)methanamine;hydrochloride | CAS Registry Number: 1257535-19-5
Synonyms: (5-BROMO-3-FLUOROPYRIDIN-2-YL)METHANAMINE HYDROCHLORIDE, MolPort-016-581-925, QC-3051, KB-82127, C-2560, (5-BROMO-3-FLUOROPYRIDIN-2-YL)METHANAMINE HCL, (5-Bromo-3-fluoropyridin-2-yl)methylamine hydrochloride

Molecular Formula:	C₆H₇BrClFN₂	Molecular Weight:	241.488583 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: QMRJGDGPGDSYMG-UHFFFAOYSA-N

• 4-Bromo-3-fluoropyridine hydrochloride

IUPAC Name: 4-bromo-3-fluoropyridine;hydrochloride | CAS Registry Number: 1159811-44-5
Synonyms: 4-Bromo-3-fluoropyridine HCl, 3-Fluoro-4-bromopyridine HCl, 3-Fluoro-4-bromopyridine hydrochloride, PubChem6660, SureCN1075567, Jsp005048, CTK8B5790, MolPort-002-041-733, ANW-50122, AKOS005145583, AC-1546, QC-4030, AK-51330, BR-51330, KB-37158, N223, AB1005077, FT-0080250, ST51052259, X9136

Molecular Formula:	C₅H₄BrClFN	Molecular Weight:	212.447363 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: NNSNDHTUFCXSAS-UHFFFAOYSA-N

• 5-Bromoquinoline-8-carbonitrile

IUPAC Name: 5-bromoquinoline-8-carbonitrile | CAS Registry Number: 507476-70-2
Synonyms: 5-bromoquinoline-8-carbonitrile, 8-Quinolinecarbonitrile, 5-bromo-, AGN-PC-005TEI, SureCN6495336, CTK1E5551, QC-8082, AK-75562, KB-245362

Molecular Formula:	C₁₀H₅BrN₂	Molecular Weight:	233.064100 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: DAYKHFAZOORREQ-UHFFFAOYSA-N

• 1-[1-[(4-methoxyphenyl)methyl]-1H-pyrazol-4-yl]-1-Propanone

IUPAC Name: 1-[1-[(4-methoxyphenyl)methyl]pyrazol-4-yl]propan-1-one | CAS Registry Number: 1105039-60-8
Synonyms: 1-(1-(4-Methoxybenzyl)-1H-pyrazol-4-yl)propan-1-one, SCHEMBL2511099, SZQSVMYOECVAEX-UHFFFAOYSA-N, AKOS022182463, AK-70906, AJ-125956, DB-020230, TX-012832, 1-Propanone,1-[1-[(4-methoxyphenyl)methyl]-1H-pyrazol-4-yl]-

Molecular Formula:	C₁₄H₁₆N₂O₂	Molecular Weight:	244.289040 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: SZQSVMYOECVAEX-UHFFFAOYSA-N

• 2-Chloro-5-ethynylpyrazine

IUPAC Name: 2-chloro-5-ethynylpyrazine | CAS Registry Number: 1196153-73-7
Synonyms: 2-chloro-5-ethynylpyrazine, (5-Chloropyrazin-2-yl)acetylene, 5-Chloro-2-ethynyl-1,4-diazine, AB69152, KB-81922

Molecular Formula:	C₆H₃ClN₂	Molecular Weight:	138.554420 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: DMJYCNHBBHKMPC-UHFFFAOYSA-N

• 1-Bromo-7-chloroisoquinoline

IUPAC Name: 1-bromo-7-chloroisoquinoline | CAS Registry Number: 1196155-73-3
Synonyms: 1-BROMO-7-CHLORO-ISOQUINOLINE, CTK8B6193, MolPort-022-907-168, ANW-52918, WTI-10478, AKOS015999929, AB70047, QC-3400, AK-94308, AM806582, BD231654, KB-11792, Y5225

Molecular Formula:	C₉H₅BrClN	Molecular Weight:	242.499700 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: OOPNOHVOHJARSZ-UHFFFAOYSA-N

• 6-chloro-4-methyl-3-Pyridinol

IUPAC Name: 6-chloro-4-methylpyridin-3-ol | CAS Registry Number: 1227502-89-7
Synonyms: 6-Chloro-4-methylpyridin-3-ol, 2-Chloro-5-hydroxy-4-picoline, 2-Chloro-5-hydroxy-4-methylpyridine, MolPort-020-248-132, AB71184, 6-CHLORO-4-METHYL-3-PYRIDINOL, BL009435, KB-82064

Molecular Formula:	C₆H₆ClNO	Molecular Weight:	143.570940 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: MEQPPYQIIPZDIH-UHFFFAOYSA-N

• 6-Bromo-3-iodo-1H-pyrazolo[4,3-b]pyridine

IUPAC Name: 6-bromo-3-iodo-2H-pyrazolo[4,3-b]pyridine | CAS Registry Number: 1305208-17-6
Synonyms: CTK4B6783, ANW-54566, AKOS016001344, AG-L-60191, AK-59603, KB-61737

Molecular Formula:	C₆H₃BrIN₃	Molecular Weight:	323.916590 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: QYKRPCLDVYDBLC-UHFFFAOYSA-N

• 1H-Pyrazolo[3,4-b]pyridine-3-carbonitrile

IUPAC Name: 2H-pyrazolo[3,4-b]pyridine-3-carbonitrile | CAS Registry Number: 956010-88-1
Synonyms: AGN-PC-023LAS, SureCN1639226, SureCN1639227, CTK8B9935, ANW-63660, AKOS016003666, PB25505, AK-78467, KB-65321, 2H-pyrazolo[3,4-b]pyridine-3-carbonitrile

Molecular Formula:	C₇H₄N₄	Molecular Weight:	144.133460 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: PVFRYQNNVUSEJD-UHFFFAOYSA-N

• 5-Bromo-4-methoxy-2-methylaniline

IUPAC Name: 5-bromo-4-methoxy-2-methylaniline | CAS Registry Number: 861084-04-0
Synonyms: SureCN680329, CTK8C1937, ANW-67475, AKOS016006773, AK-88190, KB-245198, FT-0689717

Molecular Formula:	C₈H₁₀BrNO	Molecular Weight:	216.075100 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: KSSWHWHADJOWJF-UHFFFAOYSA-N

• 3-chloro-5-(trifluoromethyl)pyridine-2-sulfonyl chloride

IUPAC Name: 3-chloro-5-(trifluoromethyl)pyridine-2-sulfonyl chloride | CAS Registry Number: 1211578-91-4
Synonyms: 3-Chloro-5-(trifluoromethyl)pyridine-2-sulfonyl chloride, MolPort-014-219-335, AKOS010996925, AK123500, KB-235725

Molecular Formula:	C₆H₂Cl₂F₃NO₂S	Molecular Weight:	280.051790 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	6

InChIKey: QFMWBBMVOOKNLN-UHFFFAOYSA-N

• 2-Hydrazino-6-methylpyrazine

IUPAC Name: (6-methylpyrazin-2-yl)hydrazine | CAS Registry Number: 19848-57-8
Synonyms: SureCN5234791, AKOS006334075, BL010276, KB-83485, 1-(6-METHYLPYRAZIN-2-YL)HYDRAZINE

Molecular Formula:	C₅H₈N₄	Molecular Weight:	124.143820 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: AATYMXZXBKVLJW-UHFFFAOYSA-N

• 3-ethynylpiperidine

IUPAC Name: 3-ethynylpiperidine | CAS Registry Number: 794533-54-3
Synonyms: AC1Q284R, AKOS006323670, AG-H-18765, PB26666, QC-3986, AK-41816, KB-31695

Molecular Formula:	C₇H₁₁N	Molecular Weight:	109.168940 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: PJNBXBSBAMXYKY-UHFFFAOYSA-N

• 6-Chloro-7-Deazaguanine

IUPAC Name: 4-chloro-7H-pyrrolo[2,3-d]pyrimidin-2-amine | CAS Registry Number: 84955-31-7
Synonyms: 4-chloro-7H-pyrrolo[2,3-d]pyrimidin-2-amine, 2-amino-4-chloropyrrolo[2,3-d]pyrimidine, 6-Chloro-7-deazaguanine, 2-Amino-4-chloro-7H-pyrrolo[2,3-d]pyrimidine, AG-H-40327, 7H-pyrrolo[2,3-d]pyrimidin-2-amine, 4-chloro-, PubChem17791, AC1NT53J, Ambpe2009368, 6-CHLORO-7-DEAZAQUININE, CTK5F3545, CTK7E0695, MolPort-003-845-783, QC-14, ANW-49697, RW1376, SBB088214, WTI-10395, ZINC16697557, AKOS005258691

Molecular Formula:	C₆H₅ClN₄	Molecular Weight:	168.583700 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: VIVLSUIQHWGALQ-UHFFFAOYSA-N

• 1H-PYRAZOLO[4,3-B]PYRIDIN-3-AMINE

IUPAC Name: 1H-pyrazolo[4,3-b]pyridin-3-amine | CAS Registry Number: 202336-32-1
Synonyms: 1H-Pyrazolo[4,3-b]pyridin-3-ylamine, SureCN123148, SureCN2330553, AGN-PC-00OW97, CTK4E3616, AKOS006352187, AG-E-48168, PB16716, QC-3421, RP20139, AK128615, BL009411, KB-12533, 3-AMINO-1H-PYRAZOLO[4,3-B]PYRIDINE

Molecular Formula:	C₆H₆N₄	Molecular Weight:	134.138640 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: MJEPPEQNLZSPAP-UHFFFAOYSA-N

• 1H-PYRROLO[2,3-D]PYRIMIDINE-6-CARBOXYLIC ACID 2-AMINO-4,7-DIHYDRO-4-OXO-

IUPAC Name: 2-amino-4-oxo-1,7-dihydropyrrolo[2,3-d]pyrimidine-6-carboxylic acid | CAS Registry Number: 188062-46-6
Synonyms: 2-Amino-4,7-dihydro-4-oxo-1H-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid, RP03947, Y8088

Molecular Formula:	C₇H₆N₄O₃	Molecular Weight:	194.147540 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	3

InChIKey: CWECFWSBLFXSPE-UHFFFAOYSA-N

• 2,3-DIMETHYL-5-HEXEN-3-OL

IUPAC Name: 2,3-dimethylhex-5-en-3-ol | CAS Registry Number: 19550-90-4
Synonyms: 2,3-Dimethyl-5-hexen-3-ol, 5-Hexen-3-ol, 2,3-dimethyl-, CID140557

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

InChIKey: YGYJSFXFOXFEOD-UHFFFAOYSA-N

• 2-(BOC-AMINO)-3-BUTEN-1-OL

IUPAC Name: tert-butyl N-(1-hydroxybut-3-en-2-yl)carbamate | CAS Registry Number: 169324-82-7
Synonyms: AGN-PC-00MVQQ, 2-(boc-amino)-3-buten-1-ol, CTK4D3268, DAlc2-H_000056, AG-E-18672, BCB04_000219, KB-163296, Carbamic acid, [1-(hydroxymethyl)-2-propenyl]-, 1,1-dimethylethyl ester, Carbamic acid,N-[1-(hydroxymethyl)-2-propen-1-yl]-, 1,1-dimethylethyl ester, Carbamicacid, [1-(hydroxymethyl)-2-propenyl]-, 1,1-dimethylethyl ester (9CI)

Molecular Formula:	C₉H₁₇NO₃	Molecular Weight:	187.236180 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: HYVYNSIWYIWTCK-UHFFFAOYSA-N

• 3-PHENYLCYCLOBUTANONE 95%

IUPAC Name: 3-phenylcyclobutan-1-one | CAS Registry Number: 52784-31-3
Synonyms: 3-Phenylcyclobutanone, AmbitBD625, MolPort-000-929-131, ZINC02525591, CID142963

Molecular Formula:	C₁₀H₁₀O	Molecular Weight:	146.185800 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: BVQSFCUGCAZOJQ-UHFFFAOYSA-N

• 1,4-DIHYDRO-4-OXOTHIENO[2,3-D]PYRIMIDINE-6-CARBOXYLIC ACID

IUPAC Name: 4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid | CAS Registry Number: 439693-47-7
Synonyms: 1,4-Dihydro-4-oxothieno[2,3-d]pyrimidine-6-carboxylic acid, RP04034, Y9119

Molecular Formula:	C₇H₄N₂O₃S	Molecular Weight:	196.183260 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: VMQOKBQPYZLGEX-UHFFFAOYSA-N

• 2-(3-CHLOROBENZYLOXY)BENZOIC ACID

IUPAC Name: 2-[(3-chlorophenyl)methoxy]benzoic acid | CAS Registry Number: 121697-55-0
Synonyms: 2-(3-Chlorobenzyloxy)benzoic acid, 2-[(3-chlorobenzyl)oxy]benzoic acid, 2-[(3-chlorophenyl)methoxy]benzoic Acid, AC1PC5D6, SureCN1388211, CTK6H2597, MolPort-003-776-328, ALBB-008995, BBL014110, SBB049673, STK501022, AKOS000199449, AG-A-33538, MCULE-4089824834, QC-3482, RP06365, Y7259

Molecular Formula:	C₁₄H₁₁ClO₃	Molecular Weight:	262.688340 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: ZZLXYZLVZBXJBY-UHFFFAOYSA-N

• 3-BROMO-5-FLUOROPYRIDINE-2-CARBOXYLIC ACID

IUPAC Name: 3-bromo-5-fluoropyridine-2-carboxylic acid | CAS Registry Number: 1189513-55-0
Synonyms: 3-Bromo-5-fluoropyridine-2-carboxylic acid, 3-Bromo-5-fluoropicolinic acid, CTK4B0975, 3-Bromo-2-carboxy-5-fluoropyridine, AKOS005259665, AG-L-20651, AM62456, QC-3839, RP05132, 3-Bromo-5-fluoropyridin-2-carboxylicacid, AK-53675, KB-81891, 3-Bromo-5-fluoro-2-pyridinecarboxylic acid, FT-0679904, Y7202, C-2402, I02-3933

Molecular Formula:	C₆H₃BrFNO₂	Molecular Weight:	219.995923 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: JNOJGNTXRVBLGR-UHFFFAOYSA-N

• 6-CHLORO-5-METHYLPYRIDINE-3-CARBOXYLIC ACID

IUPAC Name: 6-chloro-5-methylpyridine-3-carboxylic acid | CAS Registry Number: 66909-29-3
Synonyms: 6-Chloro-5-methylnicotinic acid, 5-Carboxy-2-chloro-3-methylpyridine, MolPort-016-582-173, RW3819, AKOS016010399, AB71754, QC-3309, RP02688, AK116295, KB-86703, 3-CARBOXY-6-CHLORO-5-METHYLPYRIDINE, Y9777, C-2552, 6-CHLORO-5-METHYL-3-PYRIDINECARBOXYLIC ACID

Molecular Formula:	C₇H₆ClNO₂	Molecular Weight:	171.581040 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: MAOUFLRMKAFPTB-UHFFFAOYSA-N

• 2-Fluoro-4-(methylthio)aniline

IUPAC Name: 2-fluoro-4-methylsulfanylaniline | CAS Registry Number: 76180-33-1
Synonyms: SureCN388877, 4-Amino-3-fluorothioanisole, CTK2G8094, MolPort-019-937-933, 2-Fluoro-4-(methylmercapto)aniline, 2-fluoro-4-(methylsulfanyl)aniline, 2-Fluoro-4-(methylsulphanyl)aniline, AKOS016014046, Benzenamine, 2-fluoro-4-(methylthio)-, AK130291, KB-87124, 2-FLUORO-4-(METHYLTHIO)BENZENAMINE

Molecular Formula:	C₇H₈FNS	Molecular Weight:	157.208523 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: ZINVZVDSYNURHM-UHFFFAOYSA-N

• (2-Chloro-thiazol-5-ylmethyl)-ethyl-amine

IUPAC Name: N-[(2-chloro-1,3-thiazol-5-yl)methyl]ethanamine | CAS Registry Number: 120740-07-0
Synonyms: SureCN5126949, AKOS015940433, (2-Chlorothiazol-5-ylmethyl)ethylamine, AM91113, AK-51864, KB-01117, AB1010011

Molecular Formula:	C₆H₉ClN₂S	Molecular Weight:	176.667060 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: GSTCXGLYLWATEA-UHFFFAOYSA-N

• 2,6-dimethylpiperidin-4-one�hydrochloride

IUPAC Name: 2,6-dimethylpiperidin-4-one;hydrochloride | CAS Registry Number: 1005397-62-5
Synonyms: 2,6-Dimethylpiperidin-4-one hydrochloride, SureCN4884070, QC-3695, RL00050, AK131637, KB-18455

Molecular Formula:	C₇H₁₄ClNO	Molecular Weight:	163.645160 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: NGNMAFCFQYPWAU-UHFFFAOYSA-N

• 2-Chloro-3-fluoropyridin-4-ol

IUPAC Name: 2-chloro-3-fluoro-1H-pyridin-4-one | CAS Registry Number: 1184172-46-0
Synonyms: CTK8C1282, ANW-66170, AKOS016004660, AB69317, QC-3717, AK-81984, KB-68413, 2-CHLORO-3-FLUORO-4-HYDROXYPYRIDINE

Molecular Formula:	C₅H₃ClFNO	Molecular Weight:	147.534823 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: KMUSIJQLKVODNC-UHFFFAOYSA-N

• 1-(2-Bromo-5-chlorophenyl)ethanone

IUPAC Name: 1-(2-bromo-5-chlorophenyl)ethanone | CAS Registry Number: 935-99-9
Synonyms: 1-(2-BROMO-5-CHLOROPHENYL)ETHANONE, PubChem23873, SureCN3121226, CTK8B5466, ANW-48840, AKOS015919676, QC-3350, 2'-BROMO-5'-CHLOROACETOPHENONE, AK-51654, AM806605, BR-51654, KB-212820, WT-131192, W9625

Molecular Formula:	C₈H₆BrClO	Molecular Weight:	233.489640 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: BCQAWQMDMPBDBW-UHFFFAOYSA-N

• 1-(5-Fluoropyrimidin-2-yl)ethanone

IUPAC Name: 1-(5-fluoropyrimidin-2-yl)ethanone | CAS Registry Number: 905587-44-2
Synonyms: SureCN217899, CTK8B4709, ANW-45935, AKOS015998882, PB24344, QC-3377, AK-86709, KB-215410, W9324, 1-(5-FLUOROPYRIMIDIN-2-YL)ETHAN-1-ONE

Molecular Formula:	C₆H₅FN₂O	Molecular Weight:	140.115103 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: NNJJXGKCENQOJW-UHFFFAOYSA-N

• 7-Bromo-1H-pyrazolo[4,3-b]pyridine

IUPAC Name: 7-bromo-1H-pyrazolo[4,3-b]pyridine | CAS Registry Number: 1256806-33-3
Synonyms: SureCN2598398, CTK8B7378, ANW-57144, AKOS016002703, AB71461, QC-8092, 1H-Pyrazolo[4,3-b]pyridine,7-bromo-, AK-67935, KB-12535, Y5250, 1H-PYRAZOLO[4,3-B]PYRIDINE, 7-BROMO-

Molecular Formula:	C₆H₄BrN₃	Molecular Weight:	198.020060 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: UYPCJEWLLVESSX-UHFFFAOYSA-N

• 6-(Aminomethyl)-1-methyl-1H-indazole hydrochloride

IUPAC Name: (1-methylindazol-6-yl)methanamine;hydrochloride | CAS Registry Number: 1357945-57-3
Synonyms: MolPort-016-581-569, QC-2999, KB-99360, (1-methylindazol-6-yl)methanamine hydrochloride, (1-methyl-1H-indazol-6-yl)methanamine hydrochloride, (1-Methyl-1H-indazol-6-yl)methylamine hydrochloride

Molecular Formula:	C₉H₁₂ClN₃	Molecular Weight:	197.664680 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: ZMZQIKDKZAUBBK-UHFFFAOYSA-N

• 2-Naphthoxy Acetic Acid

IUPAC Name: 2-naphthalen-2-yloxyacetic acid | CAS Registry Number: 120-23-0
Synonyms: Bnoa, Betoxon, Betapal, 2-Naphthoxyacetic acid, 2-Noxa, NOXA, Phyomone, (2-Naphthyloxy)acetic acid, Gerlach 1396, 2-Naphthyloxyacetic acid, Naphthoxyacetic acid, beta-Naphthyloxyacetic acid, (2-Naphthloxy)acetic acid, O-(2-Naphthyl)glycolic acid, Acetic acid, (2-naphthyloxy)-, 2-Naphthalenoxyacetic acid, Acetic acid, (2-naphthalenyloxy)-, (2-Naphthalenyloxy)acetic acid, NAPHTHYLOXYACETIC ACID, (2-Naphthoxy)acetic acid

Molecular Formula:	C₁₂H₁₀O₃	Molecular Weight:	202.206000 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: RZCJYMOBWVJQGV-UHFFFAOYSA-N

• 2-Chloro-4-trifluoromethylphenylboronic Acid

IUPAC Name: [2-chloro-4-(trifluoromethyl)phenyl]boronic acid | CAS Registry Number: 254993-59-4
Synonyms: 2-Chloro-4-(trifluoromethyl)phenylboronic acid, 2-Chloro-4-(trifluoromethyl)benzeneboronic acid, 2-Chloro-4-trifluoromethylphenylboronic acid, 2-fluoro-4-iodophenylboronicacid, 2-Chloro-4-trifluoromethyl phenyl boronic acid, PubChem1795, ACMC-209gkh, SureCN837696, AC1MD43T, [2-chloro-4-(trifluoromethyl)phenyl]boronic Acid, KSC489M2D, CTK3I9621, MolPort-000-139-462, ACN-S003996, ACT07692, ANW-25743, SBB096690, VT1186, AKOS004119244, AB12628

Molecular Formula:	C₇H₅BClF₃O₂	Molecular Weight:	224.372610 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: JKSUCAFAUNSPLO-UHFFFAOYSA-N

• 2-fluoro-5-trifluoromethylbenzaldehyde

IUPAC Name: 2-fluoro-5-(trifluoromethyl)benzaldehyde | CAS Registry Number: 146137-78-2
Synonyms: 529222_ALDRICH, ZINC04264760, BB_SC-4555, JRD-0205, CID2734904, 2-Fluoro-5-trifluoromethyl-benzaldehyde, 2-Fluoro-5-(trifluoromethyl)benzaldehyde, 3S110711

Molecular Formula:	C₈H₄F₄O	Molecular Weight:	192.110373 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	5

InChIKey: IDLNLGMUINCSGS-UHFFFAOYSA-N

• 2-BOC-Hexahydro-Pyrrolo[3,4-C]Pyrrole

IUPAC Name: tert-butyl 3,3a,4,5,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole-2-carboxylate | CAS Registry Number: 141449-85-6
Synonyms: AS0037, 2-Boc-Hexahydro-pyrrolo[3,4-C]pyrrole

Molecular Formula:	C₁₁H₂₀N₂O₂	Molecular Weight:	212.288700 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: FYUVLZRRIRGSTE-UHFFFAOYSA-N

• 6-Methoxypyridine-3-Carbothioanide

IUPAC Name: 6-methoxypyridine-3-carbothioamide | CAS Registry Number: 175277-49-3
Synonyms: 6-methoxypyridine-3-carbothioamide, SBB055603, AG-E-25653, ZINC00124413, AC1MCKKY, Maybridge1_008676, AC1Q4F9Z, Oprea1_273258, CTK4D5806, HMS566C08, MolPort-000-146-708, 6-methoxy-3-pyridinecarbothioamide, 3-Pyridinecarbothioamide,6-methoxy-, ANW-61379, CCG-44429, AKOS000180299, AK-45169, KB-74022, FT-0621200, Y5310

Molecular Formula:	C₇H₈N₂OS	Molecular Weight:	168.216220 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: YAKXWVMVPOHRGZ-UHFFFAOYSA-N

• 3-Fluorophenacyl bromide

IUPAC Name: 2-bromo-1-(3-fluorophenyl)ethanone | CAS Registry Number: 53631-18-8
Synonyms: 2-Bromo-3'-fluoroacetophenone, 669482_ALDRICH, ZINC00166626, SPB 06322, CID2737451

Molecular Formula:	C₈H₆BrFO	Molecular Weight:	217.035043 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: ITAQNNGDCNFGID-UHFFFAOYSA-N

• 4-Bromo-1-Chloroisoquinoline

IUPAC Name: 4-bromo-1-chloroisoquinoline | CAS Registry Number: 66728-98-1
Synonyms: 4-Bromo-1-chloroisoquinoline, AIDS020733, AIDS-020733, CID459766, UX00004628

Molecular Formula:	C₉H₅BrClN	Molecular Weight:	242.499700 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: HRWILRGBDZGABZ-UHFFFAOYSA-N

• 3-(3-Chlorophenyl)prop-2-yn-1-ol

IUPAC Name: 3-(3-chlorophenyl)prop-2-yn-1-ol | CAS Registry Number: 80151-33-3
Synonyms: 3-(3-chlorophenyl)prop-2-yn-1-ol, AG-H-21563, ZINC02525615, AC1N42KX, SureCN3351668, CTK5E7523, MolPort-000-930-531, 3-(3-chlorophenyl)-2-propyn-1-ol, OR7381, AKOS004117877, 2-Propyn-1-ol,3-(3-chlorophenyl)-, RP02488, 3-(3-Chloro-phenyl)-prop-2-yn-1-ol, BL006488, KB-26801, FT-0641752, Y4129, A839855

Molecular Formula:	C₉H₇ClO	Molecular Weight:	166.604280 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: JSWQDMZGLWMJEG-UHFFFAOYSA-N

• 3-tert-butoxycarbonylamino-thiazole-4-carboxylic Acid

IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-1,3-thiazole-4-carboxylate | CAS Registry Number: 83673-98-7
Synonyms: ZINC01420756, CID6987531

Molecular Formula:	C₉H₁₁N₂O₄S-	Molecular Weight:	243.259640 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: PIWSRJPUYPNQJE-UHFFFAOYSA-M