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• 5-(TRIFLUOROMETHYL)-1,3,4-OXADIAZOL-2-OL, 95%

IUPAC Name: 5-(trifluoromethyl)-3H-1,3,4-oxadiazol-2-one | CAS Registry Number: 82476-06-0
Synonyms: AC1NT4HE, Ambcb4039990, SureCN8299796, 5-(trifluoromethyl)-3H-1,3,4-oxadiazol-2-one, CTK3D9333, AKOS006332975, KB-99339, 5-Trifluoromethyl-[1,3,4]oxadiazol-2-ol, KB-244018, 5-(trifluoromethyl)-1,3,4-oxadiazol-2(3h)-one, 5-(TRIFLUOROMETHYL)-1,3,4-OXADIAZOL-2-OL, 1,3,4-Oxadiazol-2(3H)-one, 5-(trifluoromethyl)-, InChI=1/C3HF3N2O2/c4-3(5,6)1-7-8-2(9)10-1/h(H,8,9

Molecular Formula:	C₃HF₃N₂O₂	Molecular Weight:	154.047450 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	6

InChIKey: WBAFTNAJPQGNME-UHFFFAOYSA-N

• 4-HYDROXY-5-AZAINDOLE

IUPAC Name: 1,5-dihydropyrrolo[3,2-c]pyridin-4-one | CAS Registry Number: 54415-77-9
Synonyms: 4-Hydroxy-5-azaindole, 1,5-Dihydro-4H-pyrrolo[3,2-c]pyridin-4-one, 1H-pyrrolo[3,2-c]pyridin-4(5H)-one, Pyrrolo[3,2-c]pyridin-4(5H)-one, AC1Q6DWK, SureCN981139, AC1LBK51, SureCN1154939, CTK5A0912, CTK8J1619, MolPort-019-878-541, 1H-pyrrolo[3,2-c]pyridin-4-ol, KST-1B5330, ANW-59915, AR-1B8118, RW3820, ZINC14985678, AKOS006345264, AG-K-79552, QC-2869

Molecular Formula:	C₇H₆N₂O	Molecular Weight:	134.135340 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	1

InChIKey: GTNVJVBRPMQWBQ-UHFFFAOYSA-N

• 5-(3-Fluoro-phenyl)-[1,3,4]thiadiazole-2-thiol

IUPAC Name: 5-(3-fluorophenyl)-3H-1,3,4-thiadiazole-2-thione | CAS Registry Number: 276254-76-3
Synonyms: SureCN8047555, AKOS003676637, KB-243482, 5-(3-fluorophenyl)-1,3,4-thiadiazole-2-thiol

Molecular Formula:	C₈H₅FN₂S₂	Molecular Weight:	212.267103 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: KMUGZQUJQXAZQC-UHFFFAOYSA-N

• 4-Isoquinolinol

IUPAC Name: isoquinolin-4-ol | CAS Registry Number: 3336-49-0
Synonyms: 4-ISOQUINOLINOL, 4-Isoquinolol, 4-Hydroxyisoquinoline, NSC 153682, CID18750, BRN 0114428, NSC153682, ZINC15858161, LS-86159, 5-21-03-00321 (Beilstein Handbook Reference), I14-0522

Molecular Formula:	C₉H₇NO	Molecular Weight:	145.157980 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: DXTUTXYCHFWRQC-UHFFFAOYSA-N

• 5-Thiazolecarboxylic acid, 2-(methoxymethyl)-4-methyl-, ethyl ester

IUPAC Name: ethyl 2-(methoxymethyl)-4-methyl-1,3-thiazole-5-carboxylate | CAS Registry Number: 136204-59-6
Synonyms: SCHEMBL3274867, IQZCZEBSILXGEN-UHFFFAOYSA-N, TS-00463, 2-methoxymethyl-4-methylthiazole-5-carboxylic acid ethyl ester, Ethyl 2-(Methoxymethyl)-4-methyl-1,3-thiazole-5-carboxylate

Molecular Formula:	C₉H₁₃NO₃S	Molecular Weight:	215.269420 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	5

InChIKey: IQZCZEBSILXGEN-UHFFFAOYSA-N

• 2-Chloro-6-methoxyquinazoline

IUPAC Name: 2-chloro-6-methoxyquinazoline | CAS Registry Number: 850424-11-2
Synonyms: AGN-PC-0CV94E, Quinazoline, 2-chloro-6-methoxy-, AKOS016009809, AK113695, KB-22726

Molecular Formula:	C₉H₇ClN₂O	Molecular Weight:	194.617680 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: NKHDIWOWDNCSLS-UHFFFAOYSA-N

• 1,3,4-Oxadiazol-2-amine, 5-(2,4-dichlorophenyl)-

IUPAC Name: 5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-amine | CAS Registry Number: 60160-13-6
Synonyms: 5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-amine, F2146-0617, AC1NGPP8, CTK2F1283, MolPort-004-318-408, ZINC19385684, AKOS000159982, AG-C-59730, MCULE-7389695935

Molecular Formula:	C₈H₅Cl₂N₃O	Molecular Weight:	230.050800 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: CFAKQLAZXZWZLX-UHFFFAOYSA-N

• 2-Amino-5-(2-Fluorophenyl)-1,3,4-Thiadiazole

IUPAC Name: 5-(2-fluorophenyl)-1,3,4-thiadiazol-2-amine | CAS Registry Number: 59565-51-4
Synonyms: 5-(2-Fluorophenyl)-1,3,4-thiadiazol-2-amine, 5-(2-Fluoro-phenyl)-[1,3,4]thiadiazol-2-ylamine, 5-(2-fluorophenyl)-1,3,4-thiadiazole-2-ylamine, ZINC00063851, AC1LBA51, SureCN9848091, MLS000711737, AC1Q4O49, STOCK2S-35057, CTK5B0138, MolPort-001-939-483, HMS2631P16, AR-1G5035, BBL005521, SBB010926, STK099630, AKOS000225022, AG-A-79929, AG-G-12341, MCULE-6318552772

Molecular Formula:	C₈H₆FN₃S	Molecular Weight:	195.216743 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: COIYYVXYSKVNIO-UHFFFAOYSA-N

• 1H-Indole, 7-bromo-5-(trifluoromethyl)-

IUPAC Name: 7-bromo-4-(trifluoromethyl)-1H-indole | CAS Registry Number: 875306-23-3
Synonyms: 7-Bromo-4-trifluoromethyl-1H-indole

Molecular Formula:	C₉H₅BrF₃N	Molecular Weight:	264.041910 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: DCIQJRYJGLTTMJ-UHFFFAOYSA-N

• 7-hydroxy-3-methyl-2H-chromen-2-one

IUPAC Name: 7-hydroxy-3-methylchromen-2-one | CAS Registry Number: 4069-67-4
Synonyms: AGN-PC-00LM3I, CHEMBL593424, CTK8I6245, CHEBI:690513, AKOS006330322, AB50338, 2H-1-Benzopyran-2-one, 7-hydroxy-3-methyl-, 7-HYDROXY-3-METHYL-2H-1-BENZOPYRAN-2-ONE

Molecular Formula:	C₁₀H₈O₃	Molecular Weight:	176.168720 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: ZLQJVGSVJRBUNL-UHFFFAOYSA-N

• 4-(chloromethyl)-1,2,3-thiadiazole-5-carboxylic acid (CAS: 183303-20-0)

• 5-BUTYL-1,3,4-THIADIAZOL-2-AMINE

IUPAC Name: 5-butyl-1,3,4-thiadiazol-2-amine | CAS Registry Number: 14068-54-3
Synonyms: Enamine_001382, STOCK2S-53321, 5-butyl-1,3,4-thiadiazol-2-amine, MolPort-000-148-132, ZINC01871295, HMS1397O18, ALBB-009389, STK007771, CID1622592

Molecular Formula:	C₆H₁₁N₃S	Molecular Weight:	157.236640 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: ZVMPWERUANCLFH-UHFFFAOYSA-N

• 2-Chloro-3-ethynyl-quinoline

IUPAC Name: 2-chloro-3-ethynylquinoline | CAS Registry Number: 1000782-65-9
Synonyms: 2-chloro-3-ethynylquinoline, AKOS006304634, KB-229440

Molecular Formula:	C₁₁H₆ClN	Molecular Weight:	187.625040 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: IVPMJQRHVZSWCP-UHFFFAOYSA-N

• 5-Methyl-1,3,4-Oxadiazol-2(3H)-One

IUPAC Name: 5-methyl-3H-1,3,4-oxadiazol-2-one | CAS Registry Number: 3069-67-8
Synonyms: 5-Methyl-1,3,4-oxadiazol-2(3H)-one, 5-methyl-1,3,4-oxadiazol-2(3H)one, 5-methyl-3H-1,3,4-oxadiazol-2-one, 5-methyl-1,3,4-oxadiazol-2-ol, AG-F-01519, AC1NT4HC, SureCN508673, SureCN685868, Ambcb4040622, CHEMBL504001, Jsp005787, CTK4G5725, MolPort-003-824-969, MolPort-008-154-412, ACN-S002070, 5-Methyl-[1,3,4]oxadiazol-2-ol, ANW-50087, ZINC22112808, AKOS005174226, AKOS013464203

Molecular Formula:	C₃H₄N₂O₂	Molecular Weight:	100.076060 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: NNXROHRFMWHXNH-UHFFFAOYSA-N

• 1H-Indole-7-carboxylic acid, 5-(trifluoromethyl)-

IUPAC Name: 5-(trifluoromethyl)-1H-indole-7-carboxylic acid | CAS Registry Number: 875306-19-7
Synonyms: SCHEMBL5189398, MEAOZPVNHLARQW-UHFFFAOYSA-N, 5-trifluoromethyl-1H-indole-7-carboxylic acid, 5-(trifluoromethyl)-1H-indole-7-carboxylic acid

Molecular Formula:	C₁₀H₆F₃NO₂	Molecular Weight:	229.155350 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: MEAOZPVNHLARQW-UHFFFAOYSA-N

• 2-Amino-5-cyclopropyl-1,3,4-thiadiazole

IUPAC Name: 5-cyclopropyl-1,3,4-thiadiazol-2-amine | CAS Registry Number: 57235-50-4
Synonyms: 5-cyclopropyl-1,3,4-thiadiazol-2-amine, 5-cyclopropyl-1,3,4-thiadiazole-2-ylamine, ZINC00115392, AC1LERUE, ACMC-20ao4n, Enamine_005503, SureCN295263, CTK5A6501, MolPort-000-147-519, BB_SC-7618, HMS1409K03, AC1Q5369, ALBB-001536, BBL013626, SBB020138, STK346809, AKOS000269268, AG-G-01748, MCULE-6840732084, RP01291

Molecular Formula:	C₅H₇N₃S	Molecular Weight:	141.194180 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: AVLUMBXGKFNNAS-UHFFFAOYSA-N

• (6-methylimidazo[1,2-b]pyridazin-2-yl)methanamine

IUPAC Name: (6-methylimidazo[1,2-b]pyridazin-2-yl)methanamine | CAS Registry Number: 1201597-28-5
Synonyms: SCHEMBL1507177, GPISNHXVZGEQCC-UHFFFAOYSA-N, AKOS022714475, DA-14602, 1-(6-methylimidazo[1,2-b]pyridazin-2-yl)methanamine

Molecular Formula:	C₈H₁₀N₄	Molecular Weight:	162.191800 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: GPISNHXVZGEQCC-UHFFFAOYSA-N

• 5-(4-chlorophenyl)-1,3,4-thiadiazole-2-thiol

IUPAC Name: 5-(4-chlorophenyl)-3H-1,3,4-thiadiazole-2-thione | CAS Registry Number: 63857-85-2
Synonyms: 5-(4-chlorophenyl)-3H-1,3,4-thiadiazole-2-thione, NSC137056, AC1NNXX6, SureCN972899, CTK2F7572, AKOS003677661, NSC-137056, F9995-0978

Molecular Formula:	C₈H₅ClN₂S₂	Molecular Weight:	228.721700 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: NGMTZWFKSLNRMT-UHFFFAOYSA-N

• 1,3(2H,4H)-Isoquinolinedione, 6-bromo-

IUPAC Name: 7-bromo-4H-isoquinoline-1,3-dione | CAS Registry Number: 501130-49-0
Synonyms: AB66115, 7-BROMO-1,3(2H,4H)-ISOQUINOLINEDIONE, 7-BROMOISOQUINOLINE-1,3(2H,4H)-DIONE, 1,3(2H,4H)-ISOQUINOLINEDIONE, 7-BROMO-, 7-BROMO-1,2,3,4-TETRAHYDROISOQUINOLINE-1,3-DIONE

Molecular Formula:	C₉H₆BrNO₂	Molecular Weight:	240.053440 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: KGFZTGLQLRNJLX-UHFFFAOYSA-N

• 2-Amino-5-(2-Furyl)-1,3,4-Thiadiazole

IUPAC Name: 5-(furan-2-yl)-1,3,4-thiadiazol-2-amine | CAS Registry Number: 4447-45-4
Synonyms: Oprea1_415011, Oprea1_630992, MLS000107063, STOCK2S-52999, NSC522432, CID351610, ZINC17173600, BAS 00599027, SMR000111435, 5-(2-Furyl)-1,3,4-thiadiazol-2-ylamine, 1,3,4-Thiadiazol-2-amine, 5-(2-furyl)-, 5-Furan-2-yl-[1,3,4]thiadiazol-2-ylamine

Molecular Formula:	C₆H₅N₃OS	Molecular Weight:	167.188400 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: NJIPARYFCVPPCA-UHFFFAOYSA-N

• 3-Bromo-1H-pyrrolo[2,3-b]pyridine-4-carboxylic acid

IUPAC Name: 3-bromo-1H-pyrrolo[2,3-b]pyridine-4-carboxylic acid | CAS Registry Number: 1190314-17-0
Synonyms: 3-BROMO-7-AZAINDOLE-4-CARBOXYLIC ACID, 3-BROMO-1H-PYRROLO[2,3-B]PYRIDINE-4-CARBOXYLIC ACID, SureCN2312026, PB34742, KB-234837, 1H-PYRROLO[2,3-B]PYRIDINE-4-CARBOXYLIC ACID, 3-BROMO-

Molecular Formula:	C₈H₅BrN₂O₂	Molecular Weight:	241.041500 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: DLHZKMNKZGVAEW-UHFFFAOYSA-N

• 1H-Pyrrolo[2,3-b]pyridine-5-carboxylic acid, ethyl ester

IUPAC Name: ethyl 1H-pyrrolo[2,3-b]pyridine-5-carboxylate | CAS Registry Number: 864681-18-5
Synonyms: SureCN298121, AGN-PC-005K4H, KB-66252, 1H-Pyrrolo[2,3-b]pyridine-5-carboxylic acid,ethyl ester

Molecular Formula:	C₁₀H₁₀N₂O₂	Molecular Weight:	190.198600 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: YUDZVBURRABHNF-UHFFFAOYSA-N

• 5-(pyridin-4-yl)-1,3,4-thiadiazole-2(3H)-thione

IUPAC Name: 5-pyridin-4-yl-3H-1,3,4-thiadiazole-2-thione | CAS Registry Number: 13581-25-4
Synonyms: 5-(pyridin-4-yl)-1,3,4-thiadiazole-2-thiol, AC1NRXV6, SureCN969939, CHEMBL596214, CTK0F4035, CHEBI:692356, MolPort-002-738-405, DNC014388, STK328652, AKOS005174322, MCULE-1265725983, KB-243965, ST4122310, 5-(4-pyridyl)-1,3,4-thiadiazole-2-thiol, ST45106367, 5-pyridin-4-yl-3H-1,3,4-thiadiazole-2-thione, 1,3,4-Thiadiazole-2(3H)-thione, 5-(4-pyridinyl)-, A3913/0166462

Molecular Formula:	C₇H₅N₃S₂	Molecular Weight:	195.264700 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: BSPHQWQMWIUIPM-UHFFFAOYSA-N

• 1H-Pyrrolo[2,3-D]pyrimidine-2,4(3H,7H)-Dione

IUPAC Name: 1,7-dihydropyrrolo[2,3-d]pyrimidine-2,4-dione | CAS Registry Number: 39929-79-8
Synonyms: 7H-pyrrolo[2,3-d]pyrimidine-2,4-diol, 7-Deazaxanthine, 2,6-Dihydroxy-7-deazapurine, 2,4-Dihydroxy-7H-pyrrolo[2,3-d]pyrimidine, 2,4-hydroxy-7H-pyrrolo-(2,3-d)pyrimidine, 1,7-Dihydro-pyrrolo[2,3-d]pyrimidine-2,4-dione, AG-F-41139, 1,7-dihydropyrrolo[2,3-d]pyrimidine-2,4-dione, 1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione, pyrrolo[2,3-d]pyrimidine-2,4-diol, DEAZAXANTHINE, PubChem23154, AC1Q79BQ, SureCN1014230, SureCN1460298, SureCN9213933, KSC222C8F, 2,4-Dihydroxy-7-deazapurine, CHEMBL122899, Jsp006915

Molecular Formula:	C₆H₅N₃O₂	Molecular Weight:	151.122800 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	2

InChIKey: HASUWNAFLUMMFI-UHFFFAOYSA-N

• 2,2-dimethylchroman-4-ol

IUPAC Name: 2,2-dimethyl-3,4-dihydrochromen-4-ol | CAS Registry Number: 71649-83-7
Synonyms: AC1MRCM8, SCHEMBL3580439, MolPort-003-728-196, HMS1646C06, AKOS006313316, 2,2-dimethyl-3,4-dihydrochromen-4-ol, DA-03964, 2,2-dimethyl-3,4-dihydro-2H-chromen-4-ol, BB 0263227, EU-0063367

Molecular Formula:	C₁₁H₁₄O₂	Molecular Weight:	178.227660 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: COJJXYXOKBNPCL-UHFFFAOYSA-N

• (6,7-Dihydro-5H-pyrrolo[1,2-b][1,2,4]triazol-5-yl)-methanol

IUPAC Name: [(5S)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazol-5-yl]methanol | CAS Registry Number: 1190392-80-3
Synonyms: (S)-(6,7-Dihydro-5H-pyrrolo[1,2-b][1,2,4]triazol-5-yl)methanol, SureCN1155877, CTK8B9207, ANW-62205, AKOS016005555, AK102351, KB-210535

Molecular Formula:	C₆H₉N₃O	Molecular Weight:	139.155160 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: OKLMNNIODAMXJU-YFKPBYRVSA-N

• 1-tert-Butyl-1H-[1,2,3]triazole-4-carboxylic acid

IUPAC Name: 1-tert-butyltriazole-4-carboxylic acid | CAS Registry Number: 1260665-09-5
Synonyms: 1-TERT-BUTYL-1H-1,2,3-TRIAZOLE-4-CARBOXYLIC ACID, SCHEMBL14234540, MolPort-029-460-541, ZINC79065572, AKOS023362674, AB72982, MCULE-5413910772, NE30622, AK336754, 1-(tert-Butyl)-1H-1,2,3-triazole-4-carboxylic acid, Z1837073460

Molecular Formula:	C₇H₁₁N₃O₂	Molecular Weight:	169.184 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: MNFXHDKCPWMRCJ-UHFFFAOYSA-N

• 2-CHLORO-3-IODOQUINOLINE

IUPAC Name: 2-chloro-3-iodoquinoline | CAS Registry Number: 128676-85-7
Synonyms: 2-chloro-3-iodoquinoline, 2-chloro-3-iodo-quinoline, Quinoline, 2-chloro-3-iodo-, AGN-PC-001Z85, CTK4B6033, ANW-49095, AKOS015920168, AG-D-58936, AK-24649, BR-24649, KB-169546, FT-0648366, X9732

Molecular Formula:	C₉H₅ClIN	Molecular Weight:	289.500170 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: VAKSSUOSONRGPR-UHFFFAOYSA-N

• 2-Amino-1,3,4-thiadiazole

IUPAC Name: 1,3,4-thiadiazol-2-amine | CAS Registry Number: 4005-51-0
Synonyms: Aminothiadiazole, Aminothiadazole, 2-Aminothiadiazole, ATDA, 1,3,4-Thiadiazol-2-amine, ADTA, A-TDA, 1,3,4-Thiadiazole, 2-amino, NCIMech_000679, NSC4728, C2H3N3S, FDA 0084, NSC 4728, TF 128, 1,3,4-Thiadiazole-2-ylamine, 258881_ALDRICH, 2-Amino-1-thia-3,4-diazole, NSC-4728, EINECS 223-657-7, 1,3,4-THIADIAZOLE, 2-AMINO-

Molecular Formula:	C₂H₃N₃S	Molecular Weight:	101.130320 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: QUKGLNCXGVWCJX-UHFFFAOYSA-N

• 1-benzhydryl-azetidin-3-ylamine

IUPAC Name: 1-benzhydrylazetidin-3-amine | CAS Registry Number: 40432-52-8
Synonyms: 1-benzhydrylazetidin-3-amine, 3-amino-1-diphenylmethylazetidine, 1-benzhydryl-3-aminoazetidine, 1-benzhydryl-3-azetidinamine, 1-(diphenylmethyl)azetidin-3-amine, SBB052037, 1-(diphenylmethyl)azetidine-3-ylamine, 3-Azetidinamine, 1-(diphenylmethyl)-, AG-F-43349, 852655-92-6, PubChem10145, AC1NX5MV, SureCN72466, Jsp006994, CTK3J6445, MolPort-001-769-433, HT788, ACN-S001608, ACT08974, 3-AMINO-1-BENZHYDRYLAZETIDIN

Molecular Formula:	C₁₆H₁₈N₂	Molecular Weight:	238.327520 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: LYTNNHXGUOKXFI-UHFFFAOYSA-N

• 4-Hydroxy-2,2-dimethyl-chroman-5-carboxylic acid

IUPAC Name: 4-hydroxy-2,2-dimethyl-3,4-dihydrochromene-5-carboxylic acid | CAS Registry Number: 158227-26-0
Synonyms: 4-Hydroxy-2,2-dimethylchroman-5-carboxylic acid, AKOS027337825, CS-W000498, AK339624

Molecular Formula:	C₁₂H₁₄O₄	Molecular Weight:	222.240 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: YEFMXAXWEWYHNI-UHFFFAOYSA-N

• 3,3-Difluoroazetidine hydrochloride

IUPAC Name: 3,3-difluoroazetidine;hydrochloride | CAS Registry Number: 288315-03-7
Synonyms: Azetidine, 3,3-difluoro-, hydrochloride (1:1), ACMC-1CLFN, AC1MBXQ6, SureCN79422, 665584_ALDRICH, CTK3J6168, 3,3-DIFLUOROAZETIDINE HCL, MolPort-000-154-249, HT009, 3,3-DIFLUOROAZETIDINE, HCL, ANW-49440, QC-688, WTI-10327, AKOS005063365, MCULE-3193422535, PB30826, RP08140, AK-39786, BR-39786, KB-27993

Molecular Formula:	C₃H₆ClF₂N	Molecular Weight:	129.536246 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: CDBAEFXTCRKJPZ-UHFFFAOYSA-N

• 1,3,4-Thiadiazole-2(3H)-thione, 5-(2-chlorophenyl)- (CAS: 60812-42-2)

• 5-[4-(tert-butyl)phenyl]-1,3,4-oxadiazol-2-ylhydrosulfide

IUPAC Name: 5-(4-tert-butylphenyl)-3H-1,3,4-oxadiazole-2-thione | CAS Registry Number: 306936-90-3
Synonyms: 5-(4-tert-butylphenyl)-1,3,4-oxadiazole-2-thiol, F2146-0017, 5-(4-tert-Butyl-phenyl)-3H-[1,3,4]oxadiazole-2-thione, BAS 01290791, AC1LEPL0, Maybridge1_008873, CBMicro_004022, SureCN414994, Ambcb5952545, CTK6A4978, HMS566L07, MolPort-001-756-889, MolPort-001-960-836, SMSF0012694, STK411169, AKOS000295211, AKOS000575630, AG-A-81331, CB06206, MCULE-9795747980

Molecular Formula:	C₁₂H₁₄N₂OS	Molecular Weight:	234.317360 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: ATIYHEZPBLMRNI-UHFFFAOYSA-N

• 5-Fluoro-3,3-dimethyl-2,3-dihydro-1H-indole

IUPAC Name: 5-fluoro-3,3-dimethyl-1,2-dihydroindole | CAS Registry Number: 225642-33-1
Synonyms: SureCN2258910, 5-FLUORO-3,3-DIMETHYLINDOLINE

Molecular Formula:	C₁₀H₁₂FN	Molecular Weight:	165.207383 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: OJVRHJFNQKFPBY-UHFFFAOYSA-N

• 1H-1,4-Benzodiazepine-3-acetic acid, 2,3,4,5-tetrahydro-2-oxo-, methyl ester

IUPAC Name: methyl 2-(2-oxo-1,3,4,5-tetrahydro-1,4-benzodiazepin-3-yl)acetate | CAS Registry Number: 680973-03-9
Synonyms: Methyl 2-(2-oxo-2,3,4,5-tetrahydro-1H-benzo[e][1,4]diazepin-3-yl)acetate, AKOS027336339

Molecular Formula:	C₁₂H₁₄N₂O₃	Molecular Weight:	234.255 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: KIOMUHRQSRNYAV-UHFFFAOYSA-N

• 6-Bromo-1,4-benzodioxane

IUPAC Name: 7-bromo-2,3-dihydro-1,4-benzodioxine | CAS Registry Number: 52287-51-1
Synonyms: 538523_ALDRICH, ZINC04208942, ZERO/009929, EINECS 257-817-2, CID104141, 6-Bromo-2,3-dihydro-1,4-benzodioxin

Molecular Formula:	C₈H₇BrO₂	Molecular Weight:	215.043980 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: LFCURAJBHDNUNG-UHFFFAOYSA-N

• 1H-pyrrolo[3,2-b]pyridine-6-carboxylic acid, ethyl ester

IUPAC Name: ethyl 1H-pyrrolo[3,2-b]pyridine-6-carboxylate | CAS Registry Number: 1261885-66-8
Synonyms: 1H-PYRROLO[3,2-B]PYRIDINE-6-CARBOXYLIC ACID ETHYL ESTER, PB33427, KB-219029, ETHYL 1H-PYRROLO[3,2-B]PYRIDINE-6-CARBOXYLATE

Molecular Formula:	C₁₀H₁₀N₂O₂	Molecular Weight:	190.198600 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: NAJRZBFAOZOKDX-UHFFFAOYSA-N

• 7-Bromo-1-methyl-1,2,3,4-tetrahydro-isoquinoline; compound with oxalic acid

IUPAC Name: 7-bromo-1-methyl-1,2,3,4-tetrahydroisoquinoline | CAS Registry Number: 1176414-95-1
Synonyms: 7-bromo-1-methyl-1,2,3,4-tetrahydroisoquinoline, SCHEMBL1011034, XACRZPKKWVBSHB-UHFFFAOYSA-N, MFCD18306484, AKOS012576255, AK336781, 7-Bromo-1-methyl-1,2,3,4-tetrahydro-isoquinoline, Isoquinoline, 7-bromo-1,2,3,4-tetrahydro-1-methyl-

Molecular Formula:	C₁₀H₁₂BrN	Molecular Weight:	226.117 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: XACRZPKKWVBSHB-UHFFFAOYSA-N

• 7-bromo-1H-Pyrrolo[3,2-b]pyridine

IUPAC Name: 7-bromo-1H-pyrrolo[3,2-b]pyridine | CAS Registry Number: 1190318-63-8
Synonyms: 7-Bromo-4-azaindole, 7-bromo-1H-pyrrolo[3,2-b]pyridine, CTK8C2966, MolPort-022-405-750, ANW-69372, ZINC44712995, AKOS016006288, PB10981, AK-30511, KB-46120, FT-0653279, ST51056729, S14-1689

Molecular Formula:	C₇H₅BrN₂	Molecular Weight:	197.032000 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: GMAJQSFTXCWJHA-UHFFFAOYSA-N

• 1H-Indazol-3-Carbonic Acid

IUPAC Name: 1H-indazole-3-carboxylic acid | CAS Registry Number: 4498-67-3
Synonyms: 1H-Indazole-3-carboxylic acid, Indazole-3-carboxylic acid, Benzopyrazole-3-carboxylic acid, MLS000085703, 56915_FLUKA, ZERO/005535, ALBB-006238, CID78250, EINECS 224-794-5, NSC520610, NSC 520610, SMR000020832, TL8003127, UX00000511

Molecular Formula:	C₈H₆N₂O₂	Molecular Weight:	162.145440 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: BHXVYTQDWMQVBI-UHFFFAOYSA-N

• 2-(3-Methyl-[1,2,4]triazol-4-yl)-benzoic acid (CAS: 25380-37-4)

• 8-Bromo-3-methyl-[1,2,4]triazolo[4,3-a]pyridine

IUPAC Name: 8-bromo-3-methyl-[1,2,4]triazolo[4,3-a]pyridine | CAS Registry Number: 54230-90-9
Synonyms: 8-BROMO-3-METHYL-[1,2,4]TRIAZOLO[4,3-A]PYRIDINE, SureCN1155698, PB15189, KB-250263

Molecular Formula:	C₇H₆BrN₃	Molecular Weight:	212.046640 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: DWOFCCIXSLDUSD-UHFFFAOYSA-N

• 1-BENZYL-4-(HYDROXYMETHYL)-1H-1,2,3-TRIAZOLE

IUPAC Name: (1-benzyltriazol-4-yl)methanol | CAS Registry Number: 28798-81-4
Synonyms: (1-benzyl-1H-1,2,3-triazol-4-yl)methanol, benzyltriazolylmethanol, AGN-PC-00DFJG, SureCN2494737, CHEMBL403608, CTK4G2125, MolPort-001-770-418, ANW-74051, SBB090969, ZINC09339942, AKOS005072057, AG-E-93007, CB-0715, MCULE-5609910752, RP11213, AK-87143, (1-benzyl-1,2,3-triazol-4-yl)methanol, KB-205046, FT-0680890, [1-benzyl-1,2,3-triazol-4-yl]methan-1-ol

Molecular Formula:	C₁₀H₁₁N₃O	Molecular Weight:	189.213840 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: SXNXKULRKDCYLM-UHFFFAOYSA-N

• 7-Hydroxy-4-(trifluoromethyl)coumarin

IUPAC Name: 7-hydroxy-4-(trifluoromethyl)chromen-2-one | CAS Registry Number: 575-03-1
Synonyms: 7,4-Hfc, Maybridge1_006885, 7-Hydroxy-4-trifluoromethylcoumarin, 368512_ALDRICH, 4-(Trifluoromethyl)umbelliferone, 91881_FLUKA, AIDS089100, AIDS-089100, NSC138174, SBB006559, ZINC00057916, C084236, 2H-Benzopyran-2-one, 7-hydroxy-4-(trifluoromethyl)-, 2H-1-Benzopyran-2-one, 7-hydroxy-4-(trifluoromethyl)-, InChI=1/C10H5F3O3/c11-10(12,13)7-4-9(15)16-8-3-5(14)1-2-6(7)8/h1-4,14

Molecular Formula:	C₁₀H₅F₃O₃	Molecular Weight:	230.140110 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	6

InChIKey: CCKWMCUOHJAVOL-UHFFFAOYSA-N

• 1-Azetidineethanol

IUPAC Name: 2-(azetidin-1-yl)ethanol | CAS Registry Number: 67896-18-8
Synonyms: 2-(Azetidin-1-yl)ethanol, SureCN378213, CTK5C6875, N-(2-HYDROXYETHYL)AZETIDINE, AKOS006331671, AG-G-57883, QC-3606, AK116274, KB-223645

Molecular Formula:	C₅H₁₁NO	Molecular Weight:	101.146940 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: ZVZDSUOAJCQVDF-UHFFFAOYSA-N

• 5-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)-1H-tetrazole

IUPAC Name: 5-[[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]-2H-tetrazole | CAS Registry Number: 775351-44-5
Synonyms: KB-243520, 5-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)-1h-tetrazole

Molecular Formula:	C₁₄H₁₉BN₄O₂	Molecular Weight:	286.137260 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: OMGRYPUOYXVMDY-UHFFFAOYSA-N

• 2-(chloromethyl)-5-Methyl-1,3,4-Oxadiazole

IUPAC Name: 2-(chloromethyl)-5-methyl-1,3,4-oxadiazole | CAS Registry Number: 3914-42-9
Synonyms: ZERO/004637, TOS-BB-1221, ALBB-003933, STK500250, ZINC04200339, CID3826620, 2-(chloromethyl)-5-methyl-1,3,4-oxadiazole, 1-(2-methyl-1,3-thiazol-4-yl)methanamine

Molecular Formula:	C₄H₅ClN₂O	Molecular Weight:	132.548300 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: KJLQSWULHSLSOM-UHFFFAOYSA-N

• 3H-Oxazolo[4,5-b]pyridin-2-one

IUPAC Name: 3H-[1,3]oxazolo[4,5-b]pyridin-2-one | CAS Registry Number: 60832-72-6
Synonyms: CHEBI:38580, Oxazolo(4,5-b)pyridin-2(3H)-one, ZINC00166649, oxazolo[4,5-b]pyridin-2(3H)-one, SPB 06586, CID2799900, [1,3]oxazolo[4,5-b]pyridin-2(3H)-one

Molecular Formula:	C₆H₄N₂O₂	Molecular Weight:	136.108160 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: OVLXOTUWFLHWQT-UHFFFAOYSA-N

• 2,4,6-trichloro-Pyrido[3,2-d]pyrimidine

IUPAC Name: 2,4,6-trichloropyrido[3,2-d]pyrimidine | CAS Registry Number: 1036738-12-1
Synonyms: 2,4,6-trichloropyrido[3,2-d]pyrimidine, 2,4,6-trichloro-pyrido[3,2-d]pyrimidine, CTK8E3494, PB22765, PYRIDO[3,2-D]PYRIMIDINE, 2,4,6-TRICHLORO-

Molecular Formula:	C₇H₂Cl₃N₃	Molecular Weight:	234.469880 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: KPUMPJIRBVOFGW-UHFFFAOYSA-N