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• Propargyl Bromide

IUPAC Name: 3-bromoprop-1-yne | CAS Registry Number: 106-96-7
Synonyms: Propynyl bromide, 3-Bromopropyne, 3-Bromo-1-propyne, Propyne, 3-bromo-, Gamma-bromoallylene, 2-Propynyl bromide, 1-Propyne, 3-bromo-, 1-Bromo-2-propyne, PROPARGYL BROMIDE, Caswell No. 705, .gamma.-Bromoallylene, 1-Brom-2-propin [Czech], Propargyl bromide solution, WLN: E2UU1, P51001_ALDRICH, HSDB 6324, 530409_ALDRICH, NSC 8801, EINECS 203-447-1, CID7842

Molecular Formula:	C₃H₃Br	Molecular Weight:	118.959920 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: YORCIIVHUBAYBQ-UHFFFAOYSA-N

• Propiolic Acid

IUPAC Name: prop-2-ynoic acid | CAS Registry Number: 471-25-0
Synonyms: Propynoic acid, PROPIOLIC ACID, Carboxyacetylene, Propargylic acid, 2-Propynoic acid, Acetylenecarboxylic acid, ynoate, ynoates, Propiolsaeure, Propinsaeure, Propynoate, propinic acid, ynoate esters, ynoate ester, prop-2-ynoic acid, HC.equiv.CCOOH, Acetylenemonocarboxylate, HC#CCOOH, HC.$.CCOOH, P51400_ALDRICH

Molecular Formula:	C₃H₂O₂	Molecular Weight:	70.046780 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: UORVCLMRJXCDCP-UHFFFAOYSA-N

• Propiolic acid methyl ester

IUPAC Name: methyl prop-2-ynoate | CAS Registry Number: 922-67-8
Synonyms: Methyl propynoate, METHYL PROPIOLATE, Methyl ethynecarboxylate, Methyl acetylenecarboxylate, Propiolic acid, methyl ester, 2-Propynoic acid, methyl ester, Propynoic acid, methyl ester, 171859_ALDRICH, 81863_FLUKA, EINECS 213-083-5, Acetylenecarboxylic acid methyl ester, NSC 154164, ALBB-008926, BRN 0605462, NSC154164, ZINC01564788, AI3-37828, 2-Propynoic acid, methyl ester (9CI), SB 01817, LS-123962

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

InChIKey: IMAKHNTVDGLIRY-UHFFFAOYSA-N

• Propynoic Acid Amide

IUPAC Name: prop-2-ynamide | CAS Registry Number: 7341-96-0
Synonyms: Propiolamide, 2-Propynamide, prop-2-ynamide, propiolic acid amide, HC.equiv.CCONH2, HC.$.CCONH2, CHEBI:51764, NSC520954, CID101445, ZINC01604909

Molecular Formula:	C₃H₃NO	Molecular Weight:	69.062020 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: HCJTYESURSHXNB-UHFFFAOYSA-N

• SPDP

IUPAC Name: (2,5-dioxopyrrolidin-1-yl) 3-pyridin-2-yldisulfanylpropanoate | CAS Registry Number: 68181-17-9
Synonyms: BICL210, P3415_SIGMA, Nonsymmetrical disulfide analog, NSC677449, AIDS032895, AIDS-032895, EINECS 269-034-3, CID100682, NSC344485, N-Succinimidyl 3-(2-pyridyldithio)propionate, Succinimidyl 3-(2-pyridyldithio)propionate, 3-(2-Pyridyldithio)propionic acid N-hydroxysuccinimide ester, 1-(1-Oxo-3-(2-pyridyldithio)propoxy)pyrrolidine-2,5-dione, 2,5-Pyrrolidinedione, 1-(1-oxo-3-(2-pyridinyldithio)propoxy)-, 3-(2-PYRIDYLDITHIO)-PROPIONIC ACID N-HYDROXYSUCCINIMIDE ESTER

Molecular Formula:	C₁₂H₁₂N₂O₄S₂	Molecular Weight:	312.364680 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	5

InChIKey: JWDFQMWEFLOOED-UHFFFAOYSA-N

• tert-Butyl propiolate

IUPAC Name: tert-butyl prop-2-ynoate | CAS Registry Number: 13831-03-3
Synonyms: Propiolic acid tert-butyl ester, tert-butyl prop-2-ynoate, tert-Butyl acetylenecarboxylate, AG-D-77538, AC1LBVHY, ACMC-209chj, KSC490A4R, 419885_ALDRICH, 81862_FLUKA, CTK3J0048, MolPort-003-932-451, Propargylic Acid tert-Butyl Ester, ACT08467, ANW-20453, RW2038, SBB067435, ZINC00391907, AKOS005259870, AK-47831, KB-61410

Molecular Formula:	C₇H₁₀O₂	Molecular Weight:	126.153100 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: XGTPDIIFEPTULX-UHFFFAOYSA-N

• Thiazole-2-carboxylic acid

IUPAC Name: 1,3-thiazole-2-carboxylic acid | CAS Registry Number: 14190-59-1
Synonyms: 1,3-thiazole-2-carboxylic Acid, 2-Carboxy-1,3-thiazole, SBB053122, 14190-59-1 Thiazole-2-carboxylic acid, PubChem16257, 2-CARBOXYTHIAZOLE, ACMC-209cn5, SureCN121301, AC1MC79L, KSC173Q4L, AC1Q744P, 2-THIAZOLECARBOXYLIC ACID, CTK0H3845, MolPort-000-142-377, ANW-20655, HT1065, WT1959, WTI-10220, WTI-11917, AKOS005169248

Molecular Formula:	C₄H₃NO₂S	Molecular Weight:	129.137120 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: IJVLVRYLIMQVDD-UHFFFAOYSA-N

• Trans-1-Boc-4-(4-nitrophenyl)pyrrolidine-3-carboxylic acid

IUPAC Name: 1-[(2-methylpropan-2-yl)oxycarbonyl]-4-(4-nitrophenyl)pyrrolidine-3-carboxylic acid | CAS Registry Number: 959579-94-3
Synonyms: A845515, Boc-(trans-4-(4-nitro-phenyl)-pyrrolidine-3-carboxylic acid, 1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-(4-nitrophenyl)-3-pyrrolidinecarboxylic acid, 1-[(2-methylpropan-2-yl)oxycarbonyl]-4-(4-nitrophenyl)pyrrolidine-3-carboxylic acid

Molecular Formula:	C₁₆H₂₀N₂O₆	Molecular Weight:	336.339800 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	6

InChIKey: GSPFANURARKSQW-UHFFFAOYSA-N

• trans-4-Hydroxy-D-proline

IUPAC Name: 4-hydroxypyrrolidine-2-carboxylic acid | CAS Registry Number: 3398-22-9
Synonyms: hydroxyproline, 4-hydroxyproline, cis-Hydroxyproline, 1-Hydroxy-L-proline, L-Allohydroxyproline, cis-4-hydroxyproline, allo-L-Hydroxyproline, allo-4-Hydroxyproline, Proline, 4-hydroxy-, cis-4-Hydroxy-L-proline, Poly(l-Hydroxyproline), allo-4-Hydroxy-L-proline, nchembio.155-comp21, L-Proline, 1-hydroxy-, cis-4-Hydroxy-D-proline, L-Proline, allo-hydroxy-, D-Proline, 4-hydroxy-, cis-, L-Proline, 4-hydroxy-, trans-, L-Proline, 4-hydroxy-, cis-, Proline, 4-allo-hydroxy-, L-

Molecular Formula:	C₅H₉NO₃	Molecular Weight:	131.129860 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	4

InChIKey: PMMYEEVYMWASQN-UHFFFAOYSA-N

• Tributyl Phosphine

IUPAC Name: tributylphosphane | CAS Registry Number: 998-40-3
Synonyms: Tributylphosphine, Phosphine, tributyl-, Tri-n-butylphosphine, Tris(butyl)phosphine, Tributylphosphane, Tributylfosfin [Czech], PBu(n)3, Tributylphosphine solution, TRI-N-BUTYLPHOPHINE, NCIOpen2_005716, T49484_ALDRICH, T7567_SIGMA, 90827_FLUKA, EINECS 213-651-2, NSC 91700, UN3254, NSC91700, BRN 1738261, AI3-28071, LS-106081

Molecular Formula:	C₁₂H₂₇P	Molecular Weight:	202.316541 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: TUQOTMZNTHZOKS-UHFFFAOYSA-N

• Tricyclohexylphosphine

IUPAC Name: tricyclohexylphosphane | CAS Registry Number: 2622-14-2
Synonyms: Phosphine, tricyclohexyl-, nchem.167-comp11, TRICYCLOHEXYL PHOSPHINE, Tricyclohexylphosphine solution, 261971_ALDRICH, 455164_ALDRICH, 592285_ALDRICH, 592390_ALDRICH, EINECS 220-069-2, NSC158657, NSC 158657, ST5405754

Molecular Formula:	C₁₈H₃₃P	Molecular Weight:	280.428381 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: WLPUWLXVBWGYMZ-UHFFFAOYSA-N

• Trimethylphosphine

IUPAC Name: trimethylphosphane | CAS Registry Number: 594-09-2
Synonyms: Trimethyl phosphine, trimethylphosphane, Phosphine, trimethyl-, Trimethylphosphorus, Me3P, PMe3, Trimethylphosphine solution, 323322_ALDRICH, 324108_ALDRICH, 324116_ALDRICH, CHEBI:35890, (CH3)3P, MolPort-003-930-033, CID68983, EINECS 209-823-1, InChI=1/C3H9P/c1-4(2)3/h1-3H

Molecular Formula:	C₃H₉P	Molecular Weight:	76.077321 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: YWWDBCBWQNCYNR-UHFFFAOYSA-N

• Trimethylsilyl Acetylene

IUPAC Name: ethynyl(trimethyl)silane | CAS Registry Number: 1066-54-2
Synonyms: Trimethylsilylacetylene, Ethynyltrimethylsilane, (Trimethylsilyl)acetylene, Silane, ethynyltrimethyl-, ethynyl(trimethyl)silane, 218170_ALDRICH, EINECS 213-919-9, T138, TL8000240, InChI=1/C5H10Si/c1-5-6(2,3)4/h1H,2-4H

Molecular Formula:	C₅H₁₀Si	Molecular Weight:	98.218400 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: CWMFRHBXRUITQE-UHFFFAOYSA-N

• Z-N-ME-ASP(OTBU)-OH.DCHA

IUPAC Name: N-cyclohexylcyclohexanamine;(2S)-2-[methyl(phenylmethoxycarbonyl)amino]-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoic acid | CAS Registry Number: 42417-70-9
Synonyms: Z-N-ME-ASP -OHDCHA, SCHEMBL248887, MolPort-020-004-724

Molecular Formula:	C₂₉H₄₆N₂O₆	Molecular Weight:	518.685340 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	7

InChIKey: VTIXCSIGDUSBDL-ZOWNYOTGSA-N

• Z-N-METHYL-L-THREONINE

IUPAC Name: (2S,3R)-3-hydroxy-2-[methyl(phenylmethoxycarbonyl)amino]butanoic acid | CAS Registry Number: 253595-72-1
Synonyms: Z-N-ME-THR-OHCHA, Z-N-ME-THR-OH CHA, SCHEMBL6378351, MolPort-020-004-193, VTXCJGLSFIOQNL-KOLCDFICSA-N, AKOS015910117, N-Benzyloxycarbonyl-N-methyl-L-threonine, K-6666, I14-31095

Molecular Formula:	C₁₃H₁₇NO₅	Molecular Weight:	267.277780 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: VTXCJGLSFIOQNL-KOLCDFICSA-N

• (2S,5R)-1-(((9H-FLUOREN-9-YL)METHOXY)CARBONYL)-5-PHENYLPYRROLIDINE-2-CARBOXYLIC ACID

IUPAC Name: (2S,5R)-1-(9H-fluoren-9-ylmethoxycarbonyl)-5-phenylpyrrolidine-2-carboxylic acid | CAS Registry Number: 215190-21-9
Synonyms: (2S,5R)-1-(((9H-Fluoren-9-yl)methoxy)carbonyl)-5-phenylpyrrolidine-2-carboxylic acid, AC1MBSW0, SureCN799703, CTK4E7030, MolPort-003-725-448, ANW-24479, AKOS015837355, AKOS015999247, AG-E-57704, AK-91505, BD229920, KB-206851, Fmoc-(2S,5R)-5-phenyl-pyrrolidine-2-carboxylic acid, (2S,5R)-1-(9H-fluoren-9-ylmethoxycarbonyl)-5-phenylpyrrolidine-2-carboxylic acid, (2S,5R)-1-[(9H-fluoren-9-ylmethoxy)carbonyl]-5-phenylpyrrolidine-2-carboxylic acid, 1,2-Pyrrolidinedicarboxylicacid, 5-phenyl-, 1-(9H-fluoren-9-ylmethyl) ester, (2S,5R)-, 269078-71-9, RARECHEM EM WB 0187;(2S,5R)-FMOC-5-PHENYL-PYRROLIDINE-2-CARBOXYLIC ACID;FMOC-(2S,5R)-5-PHENYLPYRROLIDINE-2-CARBOXYLIC ACID

Molecular Formula:	C₂₆H₂₃NO₄	Molecular Weight:	413.465120 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: JEEBFSSXASHKSF-RPWUZVMVSA-N

• 1-[(2,6-DICHLOROPHENYL)METHYL]-3-(1-PYRROLIDINYLMETHYL)-1H-INDAZOL-6-AMINE

IUPAC Name: 1-[(2,6-dichlorophenyl)methyl]-3-(pyrrolidin-1-ylmethyl)indazol-6-amine | CAS Registry Number: 315203-39-5
Synonyms: CTK4G7271, AG-F-05127, KB-212690, 1-(2,6-dichlorobenzyl)-3-pyrrolidin-1-ylmethyl-1h-indazol-6-ylamine, 1-(2,6-DICHLORO-BENZYL)-3-PYRROLIDIN-1-YLMETHYL-1H-INDAZOL-6-YLAMINE, 1H-Indazol-6-amine,1-[(2,6-dichlorophenyl)methyl]-3-(1-pyrrolidinylmethyl)-, 1-(2,6-DICHLORO-BENZYL)-3-PYRROLIDIN-1-YLMETHYL-1H-INDAZOL-6-YLAMINE;1-[(2,6-dichlorophenyl)methyl]-3-(1-pyrrolidinylmethyl)-1H-indazol-6-amine

Molecular Formula:	C₁₉H₂₀Cl₂N₄	Molecular Weight:	375.294900 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: RPIVQHHCHQAMGO-UHFFFAOYSA-N

• 1,2-O-DIOCTADECYL-SN-GLYCEROL

IUPAC Name: (2S)-2,3-dioctadecoxypropan-1-ol | CAS Registry Number: 82188-61-2
Synonyms: 1,2-O-Dioctadecyl-sn-glycerol, SCHEMBL1815606, A-8862

Molecular Formula:	C₃₉H₈₀O₃	Molecular Weight:	597.050700 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: QEHCYTDFERPPPU-KDXMTYKHSA-N

• 4,7,10-TRI-(T-BUTYLOXYCARBONYLMETHYL)-1,4,7,10-TETRAAZACYCLODODECAN-1-YL-ACETIC ACID

IUPAC Name: 2-[4,7,10-tris[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid | CAS Registry Number: 137076-54-1
Synonyms: DOTA-tri-t-Bu-ester, Tri-tert-butyl 1,4,7,10-tetraazacyclododecane-1,4,7,10-tetraacetate, 2-(4,7,10-TRIS(2-TERT-BUTOXY-2-OXOETHYL)-1,4,7,10-TETRAAZACYCLODODECAN-1-YL)ACETIC ACID, DOTA-Tris(Tbu ester), AGN-PC-00CJGA, SureCN1041478, 75061_ALDRICH, TPC-M011, 75061_FLUKA, AKOS015893988, LS00126, KB-145884, I04-8426, 1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetraacetic Acid Tri-tert-butyl Ester, 1-(ethyl acetic)-4,7,10-Tris(tert-butoxy carbonylmethyl)-1,4,7,10-Tetraazacyclododecane, 2-[4,7,10-tris[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid

Molecular Formula:	C₂₈H₅₂N₄O₈	Molecular Weight:	572.734480 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	12

InChIKey: RVUXZXMKYMSWOM-UHFFFAOYSA-N

• 1,2,4-TRIAZINE-5-CARBOXYLIC ACID, 6-AMINO-

IUPAC Name: 6-amino-1,2,4-triazine-5-carboxylic acid | CAS Registry Number: 412278-71-8
Synonyms: 6-Amino-1,2,4-triazine-5-carboxylic acid, 6-AMINO-[1,2,4]TRIAZINE-5-CARBOXYLIC ACID, CTK1D5297, MolPort-004-778-462, ANW-72746, WTI-10985, AKOS006285822, AG-F-46602, AK-28261, KB-44559, FT-0692847, 1,2,4-Triazine-5-carboxylicacid, 6-amino-, 1,2,4-Triazine-5-carboxylicacid,6-amino-(9CI), 1,2,4-Triazine-5-carboxylicacid,6-amino-(9CI);1,2,4-Triazine-5-carboxylic acid, 6-amino-

Molecular Formula:	C₄H₄N₄O₂	Molecular Weight:	140.100160 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	6

InChIKey: ANYNZUPMAFITPJ-UHFFFAOYSA-N

• (2,4,6-trimethoxyphenyl)methanethiol

IUPAC Name: (2,4,6-trimethoxyphenyl)methanethiol | CAS Registry Number: 212555-23-2
Synonyms: 2,4,6-trimethyloxybenzylthiol, SCHEMBL2332266, 2,4,6-trimethoxybenzyl mercaptan, MolPort-009-679-980, WBBBQLNBASXWLG-UHFFFAOYSA-N, 2,4,6-Trimethoxybenzenemethanethiol, ZINC39075859, AKOS005063577, (2,4,6-Trimethox yphenyl) methanethiol, AK162453, FT-0686753, FT-0686784, ST24033717, A116190

Molecular Formula:	C₁₀H₁₄O₃S	Molecular Weight:	214.281360 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: WBBBQLNBASXWLG-UHFFFAOYSA-N

• 2-PIPERIDINECARBOXYLIC ACID 4-HYDROXY-,(2R,4S)-

IUPAC Name: (2S,4R)-4-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylic acid | CAS Registry Number: 175671-49-5
Synonyms: (2S,4R)-1-(tert-Butoxycarbonyl)-4-hydroxypiperidine-2-carboxylic acid, AC1MBSIY, PubChem16279, MolPort-003-725-416, 955016-25-8, ANW-22788, SBB099994, AKOS005256757, AKOS015892188, EE-0206, RP13997, AK-92210, BD230377, KB-206748, FT-0681916, I02-4181, tertbutoxycarbonylhydroxyhexahydropyridinecarboxylicacid, (2S,4R)-1-[(tert-butyl)oxycarbonyl]-4-hydroxypiperidine-2-carboxylic acid, (2S,4R)-4-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylic acid

Molecular Formula:	C₁₁H₁₉NO₅	Molecular Weight:	245.272260 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: GCAZZUFIDGXTDA-SFYZADRCSA-N

• 3-BROMO-3-METHYL-BUT-1-YNE

IUPAC Name: 3-bromo-3-methylbut-1-yne | CAS Registry Number: 6214-31-9
Synonyms: 3-Bromo-3-methylbut-1-yne, 3-bromo-3-methyl-but-1-yne, CTK5B4408, 3-BROMO-3-METHYL-1-BUTYNE, AKOS006237398, AG-G-27656, RP01503, Y9639, I14-16388

Molecular Formula:	C₅H₇Br	Molecular Weight:	147.013080 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: AETOGZWYRRUFFS-UHFFFAOYSA-N

• 4-(FMOC-AMINO)-1-METHYL-1H-IMIDAZOLE-2-CARBOXYLIC ACID

IUPAC Name: 4-(9H-fluoren-9-ylmethoxycarbonylamino)-1-methylimidazole-2-carboxylic acid | CAS Registry Number: 252206-28-3
Synonyms: 4-(Fmoc-amino)-1-methyl-1H-Imidazole-2-carboxylic Acid, SureCN1577609, CTK1A0439, 4-(9H-fluoren-9-ylmethoxycarbonylamino)-1-methyl-imidazole-2-carboxylic Acid, AKOS015896190, AG-E-76643, KB-187545, FT-0659594, ST51053122, A817716, I06-1553, 4-[(9-Fluorenylmethoxycarbonyl)amino]-1-methyl-2-imidazole-2-carboxylicacid, 1H-Imidazole-2-carboxylicacid, 4-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-1-methyl-, 4-(9H-Fluoren-9-ylmethoxycarbonylamino)-1-methyl-1H-imidazole-2-carboxylic acid, 4-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-1-methyl-2-imidazolecarboxylic acid

Molecular Formula:	C₂₀H₁₇N₃O₄	Molecular Weight:	363.366680 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: AFUJLUWSTBUALR-UHFFFAOYSA-N

• 4-AMINO-1-METHYLIMIDAZOLE-2-CARBOXYLIC ACID ETHYL

IUPAC Name: ethyl 4-amino-1-methylimidazole-2-carboxylate;hydrochloride | CAS Registry Number: 180258-46-2
Synonyms: ethyl 4-amino-1-methyl-1H-imidazole-2-carboxylate hydrochloride, PubChem23739, SureCN1852651, ACN-P000770, AKOS015900933, A57603, I14-15844, 4-Amino-1-methyl-1H-imidazole-2-carboxylic acid ethyl ester HCl

Molecular Formula:	C₇H₁₂ClN₃O₂	Molecular Weight:	205.642080 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: CQRVNNMJJDJXPE-UHFFFAOYSA-N

• (S)-2-Tryptoline-3-carboxylic acid methyl ester;(S)-2-1,2,3,4-Tetrahydronorharmane-3-carboxylic acid methylester

IUPAC Name: methyl (3S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate;hydrochloride | CAS Registry Number: 79815-18-2
Synonyms: SureCN9789674, (S)-METHYL 2,3,4,9-TETRAHYDRO-1H-PYRIDO[3,4-B]INDOLE-3-CARBOXYLATE

Molecular Formula:	C₁₃H₁₅ClN₂O₂	Molecular Weight:	266.723400 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	3

InChIKey: JQYBNWMURCUTIC-MERQFXBCSA-N

• 1-(TERT-BUTOXYCARBONYL)-4-(4-CYANOPHENYL)PYRROLIDINE-3-CARBOXYLIC ACID

IUPAC Name: 4-(4-cyanophenyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid | CAS Registry Number: 885270-65-5
Synonyms: 1-(tert-butoxycarbonyl)-4-(4-cyanophenyl)pyrrolidine-3-carboxylic acid, KB-334443, 4CH-024721

Molecular Formula:	C₁₇H₂₀N₂O₄	Molecular Weight:	316.357 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: FXCGBFMJOLRFEI-UHFFFAOYSA-N

• (Z)-2-(2-Aminothiazol-4-yl)-N-(2,2-dihydroxyethyl)-2-(hydroxyimino)acetamide

IUPAC Name: (2Z)-2-(2-amino-1,3-thiazol-4-yl)-N-(2,2-dihydroxyethyl)-2-hydroxyiminoacetamide | CAS Registry Number: 178422-40-7
Synonyms: UNII-V0490HP2FV, Thiazolylacetyl glycine oxime hydrate, FT-0662081, (Z)-2-Amino-N-(2,2-dihydroxyethyl)-|A-(hydroxyimino)-4-thiazoleacetamide

Molecular Formula:	C₇H₁₀N₄O₄S	Molecular Weight:	246.243700 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	8

InChIKey: VRXTXNVEOQTWAG-WZUFQYTHSA-N

• (Z)-Cefdinir

IUPAC Name: (6R,7R)-7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-hydroxyiminoacetyl]amino]-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid | CAS Registry Number: 178601-88-2
Synonyms: E-Cefdinir, (E)-Cefdinir, UNII-61G2M33IGF, AC1O4R30, MolPort-003-845-683, AKOS015964069, AC-1246, K673, (6R,7R)-7-[[(2E)-(2-Amino-4-thiazolyl)(hydroxyimino)acetyl]amino]-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic Acid, (6R,7R)-7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-hydroxyiminoacetyl]amino]-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Molecular Formula:	C₁₄H₁₃N₅O₅S₂	Molecular Weight:	395.413520 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	10

InChIKey: RTXOFQZKPXMALH-RWFJUVPESA-N

• (Z)-2-(2-(2-aminothiazol-4-yl)-2-(hydroxyimino)acetamido)acetic acid

IUPAC Name: 2-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-hydroxyiminoacetyl]amino]acetic acid | CAS Registry Number: 178949-03-6
Synonyms: Thiazolylacetyl glycine oxime, UNII-JBA25796RO

Molecular Formula:	C₇H₈N₄O₄S	Molecular Weight:	244.227820 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	8

InChIKey: JFHNSSMBYZTXNM-WZUFQYTHSA-N

• (6R,7R)-7-((Z)-2-(2-aminothiazol-4-yl)-2-(hydroxyimino)acetamido)-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

IUPAC Name: (6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-hydroxyiminoacetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid | CAS Registry Number: 71091-93-5
Synonyms: UNII-G9Y9M0S93M

Molecular Formula:	C₁₃H₁₃N₅O₅S₂	Molecular Weight:	383.402820 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	10

InChIKey: FMPXXFJEIVCXCL-ODXWQDPNSA-N

• (6R,7R)-7-(4-hydroxyisoxazole-3-carboxamido)-8-oxo-3-vinyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (CAS: 1330164-22-1)

• (Z)-2-(2-aminothiazol-4-yl)-2-(hydroxyimino)-N-((5-methyl-7-oxo-2,4,5,7-tetrahydro-1H-furo[3,4-d][1,3]thiazin-2-yl)methyl)acetamide (CAS: 178422-44-1)

• (6R,7R)-7-((Z)-2-(2-aminothiazol-4-yl)-2-(hydroxyimino)acetamido)-8-oxo-3-vinyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 5-oxide

IUPAC Name: (6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-hydroxyiminoacetyl]amino]-3-ethenyl-5,8-dioxo-5lambda4-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid | CAS Registry Number: 934986-48-8
Synonyms: Cefdinir Sulfoxide, SCHEMBL5325547

Molecular Formula:	C₁₄H₁₃N₅O₆S₂	Molecular Weight:	411.407 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	11

InChIKey: DCYIMCVRWITTJO-VDXAKPFFSA-N

• (R,Z)-2-((R)-((Z)-2-(2-aminothiazol-4-yl)-2-(hydroxyimino)acetamido)(carboxy)methyl)-5-ethylidene-5,6-dihydro-2H-1,3-thiazine-4-carboxylic acid

IUPAC Name: (2R,5Z)-2-[(R)-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-hydroxyiminoacetyl]amino]-carboxymethyl]-5-ethylidene-2H-1,3-thiazine-4-carboxylic acid | CAS Registry Number: 178422-39-4
Synonyms: Cefdinir Thiazine Analog

Molecular Formula:	C₁₄H₁₅N₅O₆S₂	Molecular Weight:	413.423 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	12

InChIKey: RUZZQEIIEDMRPD-NFOWBNJOSA-N

• (6R,7S)-7-((Z)-2-(2-aminothiazol-4-yl)-2-(hydroxyimino)acetamido)-8-oxo-3-vinyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

IUPAC Name: (6R,7S)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-hydroxyiminoacetyl]amino]-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid | CAS Registry Number: 178601-89-3
Synonyms: 7(S)-Cefdinir, ZINC33940339

Molecular Formula:	C₁₄H₁₃N₅O₅S₂	Molecular Weight:	395.408 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	10

InChIKey: RTXOFQZKPXMALH-JQISMDCNSA-N

• (6R,7R)-7-(2-(2-aminothiazol-4-yl)-2-oxoacetamido)-8-oxo-3-vinyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

IUPAC Name: (6R,7R)-7-[[2-(2-amino-1,3-thiazol-4-yl)-2-oxoacetyl]amino]-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid | CAS Registry Number: 79350-14-4
Synonyms: SCHEMBL1821101, (-)-(6r,7r)-7-[2-(2-amino-4-thiazolyl)glyoxylamido]-8-oxo-3-vinyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7R)-7-(2-(2-Aminothiazol-4-yl)-2-oxoacetamido)-8-oxo-3-vinyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic Acid

Molecular Formula:	C₁₄H₁₂N₄O₅S₂	Molecular Weight:	380.393 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	9

InChIKey: USEZCSSBFVPIRD-JMCQJSRRSA-N

• 2-(2-(2-(2-Aminoethoxy)ethoxy) Ethoxy)ethanol

IUPAC Name: 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethanol | CAS Registry Number: 86770-74-3
Synonyms: T4EGMA, Tetraethylene glycol monoamine, AmbCV-2815, MolPort-003-844-615, CID160103, LS-66422, 2-(2-(2-(2-Aminoethoxy)ethoxy)ethoxy)ethanol, Ethanol, 2-(2-(2-(2-aminoethoxy)ethoxy)ethoxy)-

Molecular Formula:	C₈H₁₉NO₄	Molecular Weight:	193.240760 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: ANOJXMUSDYSKET-UHFFFAOYSA-N

• 2-ISOPROPYL PYRIDINE

IUPAC Name: 2-propan-2-ylpyridine | CAS Registry Number: 644-98-4
Synonyms: 2-Isopropylpyridine, 2-(Isopropyl)pyridine, 2-(i-C3H7)-pyridine, Pyridine, 2-(1-methylethyl)-, NSC42615, MolPort-005-980-571, CID69523, EINECS 211-426-3, ZINC08294975, AC-907/25014215, InChI=1/C8H11N/c1-7(2)8-5-3-4-6-9-8/h3-7H,1-2H, 75981-47-4

Molecular Formula:	C₈H₁₁N	Molecular Weight:	121.179640 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: PFYPDUUXDADWKC-UHFFFAOYSA-N

• (3-Methylisoxazol-5-yl)methylamine

IUPAC Name: (3-methyl-1,2-oxazol-5-yl)methanamine | CAS Registry Number: 154016-55-4
Synonyms: MolPort-000-142-788, ALBB-009856, ZERO/010435, STK256663, [(3-methylisoxazol-5-yl)methyl]amine, 1-(3-methyl-1,2-oxazol-5-yl)methanamine

Molecular Formula:	C₅H₈N₂O	Molecular Weight:	112.129820 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: JKVMPILAJBLISV-UHFFFAOYSA-N

• 4-Boc-3(S)-morpholinecarboxylic acid

IUPAC Name: (3S)-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-3-carboxylic acid | CAS Registry Number: 783350-37-8
Synonyms: (S)-N-Boc-morpholine-3-carboxylic acid, (s)-4-boc-morpholine-3-carboxylic acid, (S)-Morpholine-3,4-dicarboxylic acid 4-tert-butyl ester, (s)-4-n-boc-3-morpholinecarboxylic acid, n-boc-morpoline[(3s)-cooh], (s)-4-(tert-butoxycarbonyl)morpholine-3-carboxylic acid, AG-H-14423, 4-(tert-butoxycarbonyl)morpholine-3-(s)-carboxylic acid, 4-boc-3(s)-morpholine carboxylic acid, (s)-n-t-butyloxycarbonyl-morpholine-3-carboxylic acid, (3S)-4-[(tert-butoxy)carbonyl]morpholine-3-carboxylic acid, N-Boc-morpholine-3-carboxylicacid, PubChem16868, PubChem19856, AC1LTQC8, BOC-S-MO3C-OH, SureCN185522, AC1Q1N7D, CTK5E5700, MolPort-000-001-540

Molecular Formula:	C₁₀H₁₇NO₅	Molecular Weight:	231.245680 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: KVXXEKIGMOEPSA-ZETCQYMHSA-N

• (PIPERIDIN-4-YLOXY)-ACETIC ACID

IUPAC Name: 2-piperidin-4-yloxyacetic acid | CAS Registry Number: 146117-93-3
Synonyms: (Piperidin-4-yloxy)acetic acid, Acetic acid,2-(4-piperidinyloxy)-, ACMC-20n4qh, AGN-PC-01VTH4, SureCN3557829, CTK4C4812, MolPort-009-197-993, Acetic acid, (4-piperidinyloxy)-, AKOS013183850, AG-D-90296, MCULE-8120083070, RP22261, AK-25428, KB-146074, FT-0645824, F2158-1293, Aceticacid, (4-piperidinyloxy)- (9CI); 4-Piperidinyloxyacetic acid

Molecular Formula:	C₇H₁₃NO₃	Molecular Weight:	159.183020 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: KSGBFAJYSBCOGG-UHFFFAOYSA-N

• (8aS)-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione

IUPAC Name: (8aS)-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione | CAS Registry Number: 3705-27-9
Synonyms: Cyclo(pro-gly), Cyclo(glycylprolyl), Cyclo(prolylglycyl), Cyclo(pro-O-gly), 1w1p, MLS001049064, STOCK1N-05125, CHEBI:414234, MolPort-002-509-779, CID126154, ZINC00402826, EN001860, SMR000386902, CYCLO-(GLYCINE-L-PROLINE) INHIBITOR, (S)-Hexahydro-pyrrolo[1,2-a]pyrazine-1,4-dione, (S)-Hexahydropyrrolo(1,2-a)pyrazine-1,4-dione-4-17O, (8AR)-HEXAHYDROPYRROLO[1,2-A]PYRAZINE-1,4-DIONE, Pyrrolo(1,2-a)pyrazine-1,4-dione-4-170, hexahydro-, (S)-, Pyrrolo(1,2-a)pyrazine-1,4-dione-4-17O, hexahydro-, (S)-, GIO

Molecular Formula:	C₇H₁₀N₂O₂	Molecular Weight:	154.166500 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: OWOHLURDBZHNGG-YFKPBYRVSA-N

• 4-(4-bromophenyl)-1-Boc-pyrrolidine-3-carboxylic acid

IUPAC Name: 4-(4-bromophenyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid | CAS Registry Number: 939757-97-8
Synonyms: 4-(4-bromophenyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid, AGN-PC-00VA7H, SureCN7890064, Trans-4-(4-bromophenyl)-1-Boc-pyrrolidine-3-carboxylic acid, AKOS015841216, A844759, Boc-(trans-4-(4-bromo-phenyl)-pyrrolidine-3-carboxylic acid, 4-(4-Bromo-phenyl)-pyrrolidine-1,3-dicarboxylic acid 1-tert-butyl ester, 4-(4-bromophenyl)-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-3-pyrrolidinecarboxylic acid

Molecular Formula:	C₁₆H₂₀BrNO₄	Molecular Weight:	370.238300 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: MXJJJGPIDKFWKX-UHFFFAOYSA-N

• (?-3-(FMOC-AMINO)-2-PHENYLPROPANOIC ACID

IUPAC Name: 3-(9H-fluoren-9-ylmethoxycarbonylamino)-2-phenylpropanoic acid | CAS Registry Number: 683217-60-9
Synonyms: Fmoc-beta2-DL-Homophe-OH, AC1MBSYI, SureCN120408, Fmoc-|A2-DL-Homophe-OH, 43026_ALDRICH, ()-Fmoc-2-phenyl-beta-alanine, 43026_FLUKA, (+/-)-Fmoc-2-phenyl-beta-alanine, AKOS012614455, ()-3-(Fmoc-amino)-2-phenylpropionic acid, (+/-)-3-(Fmoc-amino)-2-phenylpropionic acid, ( inverted exclamation markA)-Fmoc-2-phenyl-|A-alanine, 3-(9H-fluoren-9-ylmethoxycarbonylamino)-2-phenylpropanoic acid, ( inverted exclamation markA)-3-(Fmoc-amino)-2-phenylpropionic acid

Molecular Formula:	C₂₄H₂₁NO₄	Molecular Weight:	387.427840 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: ZPTZPWOHBIHMIJ-UHFFFAOYSA-N

• (2R)-2-[[(1R)-1-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]ETHYL]OXY]-4-BENZYL-3-MORPHOLINONE

IUPAC Name: (2R)-4-benzyl-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]morpholin-3-one | CAS Registry Number: 287930-75-0
Synonyms: (R)-4-benzyl-2-((R)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)morpholin-3-one, (2R)-4-benzyl-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]morpholin-3-one, (2R)-4-BENZYL-2-{(1R)-1-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]ETHOXY}MORPHOLIN-3-ONE, CTK4G2104, QC-589, AKOS015999459, AG-E-92957, AM84892, LS30278, AK-93359, Y0383, 3-Morpholinone,2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-4-(phenylmethyl)-, (2R)-

Molecular Formula:	C₂₁H₁₉F₆NO₃	Molecular Weight:	447.370879 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	9

InChIKey: KVPJNHLVRGUYGQ-BFUOFWGJSA-N

• (2R,5S)-FMOC-5-PHENYL-PYRROLIDINE-2-CARBOXYLIC ACID

IUPAC Name: (2R,5S)-1-(9H-fluoren-9-ylmethoxycarbonyl)-5-phenylpyrrolidine-2-carboxylic acid | CAS Registry Number: 269078-69-5
Synonyms: CTK4F8716, MolPort-003-725-446, AKOS015837389, AG-E-85255, (2R,5S)-1-[(9H-fluoren-9-ylmethoxy)carbonyl]-5-phenylpyrrolidine-2-carboxylic acid

Molecular Formula:	C₂₆H₂₃NO₄	Molecular Weight:	413.465120 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: JEEBFSSXASHKSF-BJKOFHAPSA-N

• (R)-2-AMINO-3-BENZYLOXY-1-PROPANOL HCL SALT

IUPAC Name: (2R)-2-amino-3-phenylmethoxypropan-1-ol;hydrochloride | CAS Registry Number: 58577-95-0
Synonyms: (R)-2-amino-3-(benzyloxy)propan-1-ol hydrochloride, L-Ser(Bzl)-ol*HCl, SureCN2444541, CTK8G0663, BH820, FC1254, AK119608, KB-209843

Molecular Formula:	C₁₀H₁₆ClNO₂	Molecular Weight:	217.692540 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	3

InChIKey: BJWHQBTUHVIRJJ-HNCPQSOCSA-N

• (S)-2-METHYL-2-PYRROLIDINECARBOXYLIC ACID

IUPAC Name: (2S)-2-methylpyrrolidine-2-carboxylic acid;hydrobromide | CAS Registry Number: 63399-73-5
Synonyms: SureCN6632314, CTK1I7074, L-Proline, 2-methyl-, hydrobromide

Molecular Formula:	C₆H₁₂BrNO₂	Molecular Weight:	210.068980 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: IPZNJEAFURICJF-RGMNGODLSA-N

• 1,4,7-TRIS-BOC-1,4,7,10-TETRAAZA-CYCLODODECANE

IUPAC Name: tritert-butyl 1,4,7,10-tetrazacyclododecane-1,4,7-tricarboxylate | CAS Registry Number: 175854-39-4
Synonyms: Tri-tert-Butyl 1,4,7,10-tetraazacyclododecane-1,4,7-tricarboxylate, 1,4,7-Tri-Boc-1,4,7,10-tetraazacyclododecane, ACMC-20aazv, SureCN2220355, CTK4D6018, MolPort-005-932-234, ANW-65177, AKOS015911763, AG-E-26247, AK103030, KB-261228, I14-37121, 1,4,7,10-Tetraazacyclododecane-1,4,7-tricarboxylicacid, 1,4,7-tris(1,1-dimethylethyl) ester, 1,4,7,10-Tetraazacyclododecane-1,4,7-tricarboxylicacid, tris(1,1-dimethylethyl) ester (9CI);1,4,7,10-Tetraazacyclododecane-1,4,7-tricarboxylic acid tri-tert-butyl ester;1,4,7-Tris(tert-butoxycarbonyl)-1,4,7,10-tetraazacyclododecane;4,7,10-Tris(tert-butoxycarbonyl)-1,4,7,10-tetraazacyclododecane; Tri-tert-butyl1,4,7,10-tetraazacyclotetradecane-1,4,7-tricarboxylate, N,N inverted exclamation marka,N inverted exclamation marka inverted exclamation marka-Tri-Boc-cyclen

Molecular Formula:	C₂₃H₄₄N₄O₆	Molecular Weight:	472.618660 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	7

InChIKey: ZXASHTYJQJMCQR-UHFFFAOYSA-N