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• 1-N-Boc-4-N-Bocpiperazine-2-Carboxylicacid
IUPAC Name: 1,4-bis[(2-methylpropan-2-yl)oxycarbonyl]piperazine-2-carboxylic acid | CAS Registry Number: 181955-79-3
Synonyms: 1,4-di-Boc-piperazine-2-carboxylic acid, 1-N-Boc-4-N-Boc-Piperazine-2-carboxylic acid, 1,4-bis(tert-butoxycarbonyl)piperazine-2-carboxylic acid, 1,4-Bis(N-Boc)piperazine-2-carboxylic acid, 1,4-bis[(2-methylpropan-2-yl)oxycarbonyl]piperazine-2-carboxylic Acid, 1-N-Boc-4-N-Boc-piperazine-2-carboxylicacid, 1,4-bis[(tert-butoxy)carbonyl]piperazine-2-carboxylic acid, S-1,4-diBoc-piperazine-2-carboxylic acid, SureCN22227, AGN-PC-005E4R, Jsp003726, CTK7G3287, MolPort-003-985-295, ACT09164, ANW-49435, AKOS015836556, AB11019, AC-1804, AG-C-19730, MCULE-7517195210

Molecular Formula: C15H26N2O6Molecular Weight: 330.376740 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: IIZGWFQKLVCLLA-UHFFFAOYSA-N

• 1-Cbz-3-Methylpiperazine
IUPAC Name: benzyl 3-methylpiperazine-1-carboxylate | CAS Registry Number: 84477-85-0
Synonyms: Benzyl 3-methylpiperazine-1-carboxylate, ACMC-20aowc, SureCN2579734, CTK8B8229, MolPort-003-985-332, ANW-59726, AKOS005258640, 1-CBZ-(S)-3-METHYLPIPERAZINE, MCULE-3723181351, AK-39019, A-1695, I13-0221

Molecular Formula: C13H18N2O2Molecular Weight: 234.294220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: JRPIQMPFKMFAOX-UHFFFAOYSA-N

• (+)-6-Methoxy-Alpha-Methyl-2-Naphthaleneacetic Acid
IUPAC Name: (2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid | CAS Registry Number: 22204-53-1
Synonyms: NAPROXEN, Equiproxen, Laraflex, Calosen, Reuxen, Bonyl, Axer, d-Naproxen, Novonaprox, Rheumaflex, Saritilron, Acusprain, Anexopen, Arthrisil, Artrixen, Artroxen, Bipronyl, Clinosyn, Danaprox, Flexipen

Molecular Formula: C14H14O3Molecular Weight: 230.259160 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: CMWTZPSULFXXJA-VIFPVBQESA-N

• 1-Piperidinecarboxylic acid, 3-cyano-,1,1-dimethylethyl ester
IUPAC Name: tert-butyl 3-cyanopiperidine-1-carboxylate | CAS Registry Number: 91419-53-3
Synonyms: 1-N-Boc-3-cyanopiperidine, n-boc-3-cyanopiperidine, 1-Boc-3-cyanopiperidine, tert-butyl 3-cyanopiperidine-1-carboxylate, N-Boc-3-cyano-piperidine, (+/-)-1-n-boc-3-cyano-piperidine, 1-n-boc-piperidine-3-carbonitrile, SBB066832, AG-H-75101, 3-cyano-piperidine-1-carboxylic acid tert-butyl ester, PubChem7634, AC1MBUD4, SureCN1970337, 1-n-boc-3-cyano-piperidine, KSC495C3N, AC1Q1N35, CTK3J5136, MolPort-000-151-677, BH572, ACT02053

Molecular Formula: C11H18N2O2Molecular Weight: 210.272820 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: UEFZTXGFHKPSFS-UHFFFAOYSA-N

• 1-N-Cbz-3-pyrrolidinone
IUPAC Name: benzyl 3-oxopyrrolidine-1-carboxylate | CAS Registry Number: 130312-02-6
Synonyms: 1-Cbz-3-pyrrolidinone, N-Cbz-3-Pyrrolidinone, benzyl 3-oxopyrrolidine-1-carboxylate, 1-cbz-3-pyrrolidone, 1-Z-3-Pyrrolidinone, N-Benzyloxycarbonyl-3-pyrrolidinone, 1-Carbobenzoxy-3-pyrrolidone, 1-Carbobenzyloxy-3-pyrrolidinone, benzyl-3-oxopyrrolidin-1-carboxylat, phenylmethyl 3-oxopyrrolidinecarboxylate, 1-[(Benzyloxy)carbonyl]-3-oxopyrrolidine, 1-BENZYLOXYCARBONYL-3-PYRROLIDINONE, 3-oxo-pyrrolidine-1-carboxylic acid benzyl ester, 3-Oxo-1-pyrrolidinecarboxylic acid, phenylmethyl ester, 1-Pyrrolidinecarboxylic acid, 3-oxo-, phenylmethyl ester, ZINC02585686, PubChem8349, AC1LBNVF, AC1Q6KTG, SureCN265902

Molecular Formula: C12H13NO3Molecular Weight: 219.236520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: LMHWEUQNJRXMCD-UHFFFAOYSA-N

• (S)-3-Boc-aminopiperidine
IUPAC Name: tert-butyl N-[(3S)-piperidin-3-yl]carbamate | CAS Registry Number: 216854-23-8
Synonyms: (S)-3-N-Boc-aminopiperidine, (S)-tert-butyl piperidin-3-ylcarbamate, (S)-3-(Tert-Butoxycarbonylamino)Piperidine, (S)-3-(Boc-amino)piperidine, (s)-(-)-3-tert-Butoxycarbonylaminopiperidine, tert-butyl N-[(3S)-piperidin-3-yl]carbamate, (3s)-3-aminopiperidine, 3-boc protected, TERT-BUTYL (S)-PIPERIDIN-3-YLCARBAMATE, (s)-piperidin-3-yl-carbamic acid tert-butyl ester, S-3-(Boc-amino)piperidine, PubChem11542, PubChem12565, AC1LTT0O, AC1Q1MUN, SureCN342108, (s)-3-n-boc-amino piperidine, (s)-3-n-boc-amino-piperidine, Jsp004408, 08601_FLUKA, MolPort-000-001-731

Molecular Formula: C10H20N2O2Molecular Weight: 200.278000 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: WUOQXNWMYLFAHT-QMMMGPOBSA-N

• 2-Aminoethylsulphonic Acid
IUPAC Name: 2-aminoethanesulfonic acid | CAS Registry Number: 107-35-7
Synonyms: taurine, tauphon, 2-aminoethanesulfonic acid, L-Taurine, taufon, 2-Sulfoethylamine, O-Due, Taukard, Taurinum [Latin], Aminoethanesulfonic acid, Taurina [Spanish], Taurine [INN], 2-Aminoethylsulfonic acid, aminoethylsulfonic acid, Taurine (TN), beta-Aminoethylsulfonic acid, Taurine (8CI), aminoetylsulphonic acid, 2-aminoethyl sulfonate, ethylaminesulphonic acid

Molecular Formula: C2H7NO3SMolecular Weight: 125.146880 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: XOAAWQZATWQOTB-UHFFFAOYSA-N

• 2-(quinolin-6-yl)acetic Acid
IUPAC Name: 2-quinolin-6-ylacetic acid | CAS Registry Number: 5622-34-4
Synonyms: 2-(QUINOLIN-6-YL)ACETIC ACID, 6-Quinolineacetic acid, 6-Quinoline Acetic Acid, 6-Quinolylacetic acid, Quinolin-6-yl-aceticacid, AG-F-97291, PubChem19580, quinolin-6-ylacetic acid, SureCN1163335, AGN-PC-00G6M5, MolPort-000-006-288, RW3864, SBB066352, AKOS009157465, AC-2862, LS20576, QC-3313, RP03504, AK-73087, BL006181

Molecular Formula: C11H9NO2Molecular Weight: 187.194660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: CFVILHFXMRQYSG-UHFFFAOYSA-N

• (R)-Piperidine-3-carboxylic acid ethyl ester hydrochloride
IUPAC Name: ethyl (3R)-piperidine-3-carboxylate;hydrochloride | CAS Registry Number: 37675-19-7
Synonyms: (R)-ethyl nipecotate hydrochloride, PubChem16883, SureCN5215224, CTK6F2871, (R)-ETHYL NIPECOTATE HCL, (R)-Ethyl nipecotatehydrochloride, MolPort-002-499-628, RW1087, AG-A-07690, (r)-(-)-nipecotic acid ethyl ester hcl, AC-19577, AK-45083, BR-45083, KB-63276, ST51051400, I12-0247

Molecular Formula: C8H16ClNO2Molecular Weight: 193.671140 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: ZCEGLOKZSLNARG-OGFXRTJISA-N

• (R)-N-Boc-3-pyrrolidineacetic acid
IUPAC Name: 2-[(3R)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-3-yl]acetic acid | CAS Registry Number: 204688-60-8
Synonyms: (R)-(1-Boc-Pyrrolidin-3-yl)-acetic acid, (R)-2-(1-(tert-butoxycarbonyl)pyrrolidin-3-yl)acetic acid, r-1-boc-pyrrolidin-3-acetic acid, (r)-n-boc-pyrrolidine-3-acetic acid, AG-E-50076, (r)-(1-boc-pyrrolidin-3-yl)acetic acid, (R)-(1-Boc-Pyrrolidin-3-yl)-aceticacid, (R)-1-BOC-PYRROLIDINE-3-ACETIC ACID, (R)-N-Boc-3-(R)-(1-Boc-Pyrrolidin-3-yl)-aceticacid, PubChem13365, SureCN345306, AC1LT44F, CTK1A1792, MolPort-000-001-711, ACN-S001822, ACT09216, ANW-53952, RW1031, AC-6302, PB10325

Molecular Formula: C11H19NO4Molecular Weight: 229.272860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: SKEXQIJIXQSFRX-MRVPVSSYSA-N

• 1-Cbz-4-Piperidinepropionic Acid
IUPAC Name: 3-(1-phenylmethoxycarbonylpiperidin-4-yl)propanoic acid | CAS Registry Number: 63845-33-0
Synonyms: N-Cbz-4-piperidinepropionic acid, CID9895315, C50049, 3-(1-phenylmethoxycarbonyl-4-piperidyl)propanoic Acid

Molecular Formula: C16H21NO4Molecular Weight: 291.342240 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: NZTJJLCAFTZAGK-UHFFFAOYSA-N

• 7-Fluoro-1,2,3,4-Tetrahydro-Isoquinoline Hydrochloride
IUPAC Name: 7-fluoro-1,2,3,4-tetrahydroisoquinoline;hydrochloride | CAS Registry Number: 799274-06-9
Synonyms: 7-fluoro-1,2,3,4-tetrahydroisoquinoline hydrochloride, SureCN999244, MolPort-003-985-369, ACT10829, ANW-66650, AKOS015958813, AK-30481, KB-74153, EN300-77497, A19991, F9995-1287

Molecular Formula: C9H11ClFNMolecular Weight: 187.641743 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: LOJNQXIJLCPQDR-UHFFFAOYSA-N

• 5-Thia-1-Azabicyclo[4.2.0]oct-2-Ene-2-Carboxylic Acid, 7-Amino-3-Ethenyl-8-Oxo-, (6R,7R)-
IUPAC Name: (6R,7R)-7-amino-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid | CAS Registry Number: 79349-82-9
Synonyms: AG-H-18359, 7-Amino-3-vinyl-3-cephem-4-carboxylic acid, (6R,7R)-7-amino-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7R)-7-Amino-8-oxo-3-vinyl-5-thia-1-azabicylo[4.2.0]oct-2-ene-2-carboxylic acid, AC1OIKWK, 7-AVCA, SureCN5284761, CTK2H7065, MolPort-005-938-002, SBB065760, AKOS015892740, AC-5550, K402, FT-0641715, A839658, (6R,7R)-7-Amino-8-oxo-3-vinyl-5-thia-1-azabicylo[4.2.0]oct-2-e ne-2-carboxylic acid, (6R-trans)-7-Amino-3-ethenyl-8-oxo-5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic Acid, (6R,7R)-7-AMINO-3-VINYL-8-OXO-5-THIA-1-AZABICYCLO[4.2.0]OCT-2-ENE-2-CARBOXYLIC ACID, (6R,7R)-7-azanyl-3-ethenyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylicacid, 7-amino-3-ethenyl-8-oxo-, (6R,7R)-

Molecular Formula: C9H10N2O3SMolecular Weight: 226.252300 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: GQLGFBRMCCVQLU-SVGQVSJJSA-N

• 2-Amino-4-Nitrophenol
IUPAC Name: 2-amino-4-nitrophenol | CAS Registry Number: 99-57-0
Synonyms: p-Nitro-o-aminophenol, 2-AMINO-4-NITROPHENOL, ursol 4gl, 4-Nitro-2-aminophenol, 2-Hydroxy-5-nitroaniline, Rodol 42, Phenol, 2-amino-4-nitro-, 4-Nitro-2-aminofenol, p-Nitroaminofenol [Polish], 3-Amino-4-hydroxynitrobenzene, 2-Amino-4-nitro-phenol, WLN: ZR BQ ENW, CCRIS 890, NCI-C55958, 1-Nitro-3-amino-4-hydroxybenzene, 2-Amino-4-nitrofenol [Czech], 4-Nitro-2-aminofenol [Czech], A70402_ALDRICH, HSDB 4165, MLS000331524

Molecular Formula: C6H6N2O3Molecular Weight: 154.123440 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: VLZVIIYRNMWPSN-UHFFFAOYSA-N

• (S)-4-N-Boc-piperazine-2-carboxylic acid
IUPAC Name: (2S)-4-[(2-methylpropan-2-yl)oxycarbonyl]piperazine-2-carboxylic acid | CAS Registry Number: 848482-93-9
Synonyms: (s)-1-boc-piperazine-3-carboxylic acid, (S)-4-Boc-Piperazine-2-carboxylic acid, (S)-4-N-BOC-PIPERAZINE-2-CARBOXYLIC ACID, s-bpca, 4-Boc-piperazine-2-(S)-carboxylic acid, AG-H-39606, (s)-4-(tert-butoxycarbonyl)piperazine-2-carboxylic acid, (S)-4-N-Boc-piperazine-2-carboxylicacid, 1,3-Piperazinedicarboxylic acid, 1-(1,1-dimethylethyl) ester, (3S)-, (S)-1-(tert-Butoxycarbonyl)piperazine-3-carboxylic acid, (s)-piperazine-1,3-dicarboxylic acid 1-tert-butyl ester, (s)-1,3-piperazinedicarboxylic acid, 1-(1,1-dimethylethyl) ester, (S)-4-(tert-Butoxylcarbonyl)-piperazine-2-carboxylic acid; (S)-Piperazine-1,3-dicarboxylic acid 1-tert-butyl ester, PubChem11699, AC1LT3MC, SureCN1184732, KSC653E6L, CTK5F3265, MolPort-000-001-480, ANW-48369

Molecular Formula: C10H18N2O4Molecular Weight: 230.260920 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: YRYAXQJXMBETAT-ZETCQYMHSA-N

• 1-Cbz-2-Piperidinecarboxaldehyde
IUPAC Name: benzyl 2-formylpiperidine-1-carboxylate | CAS Registry Number: 105706-76-1
Synonyms: 1-Cbz-Piperidine-2-Aldehyde, benzyl 2-formylpiperidine-1-carboxylate, 1-CBZ-2-FORMYLPIPERIDINE, 2-Formyl-piperidine-1-carboxylic acid benzyl ester, N-CBZ-2-FORMYLPIPERIDINE, AG-D-19495, N-CBZ-PIPERIDINE-2-CARBALDEHYDE, 1-Piperidinecarboxylicacid, 2-formyl-, phenylmethyl ester, 1-PIPERIDINECARBOXYLIC ACID, 2-FORMYL-, PHENYLMETHYL ESTER, PubChem17510, AC1Q6Q9G, AGN-PC-01V6L9, ACMC-20a832, CTK4A4032, MolPort-001-794-040, 1-N-CBZ-2-FORMYLPIPERIDINE, ACT07181, ANW-61404, RW1057, AKOS015855825

Molecular Formula: C14H17NO3Molecular Weight: 247.289680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: DIFLGEVEAZQPMO-UHFFFAOYSA-N

• 7-Chloro-1,2,3,4-Tetrahydroisoquinoline Hydrochloride
IUPAC Name: 7-chloro-1,2,3,4-tetrahydroisoquinoline;hydrochloride | CAS Registry Number: 73075-45-3
Synonyms: 7-CHLORO-1,2,3,4-TETRAHYDROISOQUINOLINE HYDROCHLORIDE, F9995-1264, SureCN1124954, CTK8B8993, MolPort-003-985-409, ACT10726, ANW-61756, AKOS015958730, RP26064, AK-30485, KB-74133, A20004, 7-Chhloro-1,2,3,4-tetrahydroisoquinoline hydrochloride

Molecular Formula: C9H11Cl2NMolecular Weight: 204.096340 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: OGIAIXMUSSACDB-UHFFFAOYSA-N

• (R)-4-N-Boc-2-methylpiperazine
IUPAC Name: tert-butyl (3R)-3-methylpiperazine-1-carboxylate | CAS Registry Number: 163765-44-4
Synonyms: 674761_ALDRICH, (R)-1-Boc-3-methylpiperazine, (R)-4-Boc-2-methylpiperazine, 08571_FLUKA, (R)-2-Methyl-1-Boc-piperazine, FS011292, TL8006206, tert-Butyl (R)-3-methyl-1-piperazinecarboxylate

Molecular Formula: C10H20N2O2Molecular Weight: 200.278000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: FMLPQHJYUZTHQS-MRVPVSSYSA-N

• 2-Bromo-4-methylaniline
IUPAC Name: 2-bromo-4-methylaniline | CAS Registry Number: 583-68-6
Synonyms: 2-Bromotoluidine, 2-Bromo-p-toluidine, 4-Amino-3-bromotoluene, 4-Methyl-2-bromoaniline, Benzenamine, 2-bromo-4-methyl-, p-TOLUIDINE, 2-BROMO-, NSC7092, 124087_ALDRICH, NSC 7092, 07160_FLUKA, EINECS 209-515-7, CID11422, ZINC00388149, LS-154325, ST5213807, TL80073952

Molecular Formula: C7H8BrNMolecular Weight: 186.049120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: UVRRJILIXQAAFK-UHFFFAOYSA-N

• 2-Carbethoxy Cyclopentanone
IUPAC Name: ethyl 2-oxocyclopentane-1-carboxylate | CAS Registry Number: 611-10-9
Synonyms: Ethyl 2-oxocyclopentanecarboxylate, Enamine_005519, 2-Carbethoxycyclopentanone, 2-(Ethoxycarbonyl)cyclopentanone, .alpha.-(Carboethoxy)cyclopentanone, 2-Carbethoxy-1-cyclopentanone, Ethyl cyclopentanone-2-carboxylate, 168092_ALDRICH, 29780_FLUKA, Ethyl 2-cyclopentanonecarboxylate, NSC5658, Ethyl 2-oxoocyclopentanecarboxylate, ALBB-006278, NSC22055, EINECS 210-253-0, Ethyl 2-cyclopentanone-1-carboxylate, Ethyl 2-oxo-1-cyclopentanecarboxylate, Cyclopentanecarboxylic acid, 2-oxo-, ethyl ester, 2-Cyclopentanonecarboxylic acid ethyl ester, AI3-07005

Molecular Formula: C8H12O3Molecular Weight: 156.179080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: JHZPNBKZPAWCJD-UHFFFAOYSA-N

• 3,5-Dinitroanisole
IUPAC Name: 1-methoxy-3,5-dinitrobenzene | CAS Registry Number: 5327-44-6
Synonyms: Anisole, 3,5-dinitro-, Ambap6064, Benzene, 1-methoxy-3,5-dinitro-, NSC3331, 1-Methoxy-3,5-dinitrobenzene, NSC 3331, CID79231, AI3-19029, LS-20211

Molecular Formula: C7H6N2O5Molecular Weight: 198.132940 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: OTMLGCBMOMNGCV-UHFFFAOYSA-N

• 2,4-Dinitroaniline
IUPAC Name: 2,4-dinitroaniline | CAS Registry Number: 97-02-9
Synonyms: 2,4-DINITROANILINE, Aniline, 2,4-dinitro-, 2,4-Dinitraniline, Benzenamine, 2,4-dinitro-, 2,4-Dinitroanilin, 2,4-Dinitroanilina, 2,4-Dinitrobenzenamine, 2,4-Dinitrophenylamine, 1-Amino-2,4-dinitrobenzene, WLN: WNR BZ ENW, 2,4-Dinitroanilin [German], 2,4-Dinitroanilina [Italian], CCRIS 2872, ghl.PD_Mitscher_leg0.930, HSDB 1142, D193011_ALDRICH, 45963_RIEDEL, NCI-C60753, NSC 8731, EINECS 202-553-5

Molecular Formula: C6H5N3O4Molecular Weight: 183.121600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: LXQOQPGNCGEELI-UHFFFAOYSA-N

• (R)-(-)-2-Methylpiperazine
IUPAC Name: (2R)-2-methylpiperazine | CAS Registry Number: 75336-86-6
Synonyms: R-2-Methylpiperazine, 397164_ALDRICH, NSC5277, 2-METHYL PIPERAZINE, ANHYDROUS, CID7330434, (R)-(−)-2-Methylpiperazine, FS011294, TL8005161, InChI=1/C5H12N2/c1-5-4-6-2-3-7-5/h5-7H,2-4H2,1H, 109-07-9

Molecular Formula: C5H12N2Molecular Weight: 100.162180 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: JOMNTHCQHJPVAZ-RXMQYKEDSA-N

• 3-(tert-Butoxycarbonylamino)pyrrolidine
IUPAC Name: tert-butyl N-pyrrolidin-3-ylcarbamate | CAS Registry Number: 99724-19-3
Synonyms: 3-N-Boc-amino pyrrolidine, ALBB-006290, tert-butyl pyrrolidin-3-ylcarbamate, C-3152

Molecular Formula: C9H18N2O2Molecular Weight: 186.251420 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: DQQJBEAXSOOCPG-UHFFFAOYSA-N

• 4-formyl-piperidine-1-carboxylic Acid Tert-butyl Ester
IUPAC Name: tert-butyl 4-formylpiperidine-1-carboxylate | CAS Registry Number: 137076-22-3
Synonyms: 1-Boc-4-formylpiperidine, tert-butyl 4-formyl-1-piperidinecarboxylate, C-3134

Molecular Formula: C11H19NO3Molecular Weight: 213.273460 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: JYUQEWCJWDGCRX-UHFFFAOYSA-N

• (R)-1-tert-Butoxycarbonylpyrrolidine-3-methanol
IUPAC Name: tert-butyl (3R)-3-(hydroxymethyl)pyrrolidine-1-carboxylate | CAS Registry Number: 138108-72-2
Synonyms: (R)-1-Boc-3-Hydroxymethylpyrrolidine, (R)-tert-butyl 3-(hydroxymethyl)pyrrolidine-1-carboxylate, (R)-1-Boc-3-(hydroxymethyl)pyrrolidine, (R)-3-Hydroxymethyl-pyrrolidine-1-carboxylic acid tert-butyl ester, 1-Boc-3-hydroxymethyl-pyrrolidine, AG-D-77142, (R)-1-Boc-3-hydroxymethyl-pyrrolidine, tert-butyl (3R)-3-(hydroxymethyl)pyrrolidine-1-carboxylate, (R)-3-Hydroxymethylpyrrolidine-1-carboxylic acid tert-butyl ester, 1-Pyrrolidinecarboxylic acid, 3-(hydroxymethyl)-, 1,1-dimethylethyl ester, (3R)-, AC1LTTCF, PubChem11122, SureCN514696, N-BOC-D-BETA-PROLINOL, Jsp002288, CTK4C1089, MolPort-000-004-261, WT968, ACT08452, AC-867

Molecular Formula: C10H19NO3Molecular Weight: 201.262760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: HKIGXXRMJFUUKV-MRVPVSSYSA-N

• 4,4-Difluorocyclohexanecarboxylic acid
IUPAC Name: 4,4-difluorocyclohexane-1-carboxylic acid | CAS Registry Number: 122665-97-8
Synonyms: 4,4-difluorocyclohexane-1-carboxylic Acid, 4,4-Difluorocyclohexylcarboxylic acid, 4,4-difluorocyclohexanoic acid, cyclohexanecarboxylic acid, 4,4-difluoro-, 4,4-Difluorocyclohexanecarboxylicacid, SBB053457, AG-D-49173, 4, 4 -Difluoro-cyclohexane carboxylic acid, AC1MCUUL, PubChem15915, ACMC-209aln, SureCN18199, KSC174K3T, 4,4-DifluorocyclohexanoicAcid, difluorocyclohexanecarboxylicacid, 684651_ALDRICH, Jsp001523, 4,4-Difluorocyclohexanoic acid;, CTK0H4539, MolPort-000-160-191

Molecular Formula: C7H10F2O2Molecular Weight: 164.149906 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: HYIUDFLDFSIXTR-UHFFFAOYSA-N

• 1-Boc-4-Piperidinylpropionic Acidmethyl Ester
IUPAC Name: tert-butyl 4-(3-methoxy-3-oxopropyl)piperidine-1-carboxylate | CAS Registry Number: 162504-75-8
Synonyms: Methyl N-Boc-4-piperidinepropionate, ZINC01420816, CID1502093, M17241, Tert-butyl 4-(2-methoxycarbonylethyl)piperidine-1-carboxylate

Molecular Formula: C14H25NO4Molecular Weight: 271.352600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: RWDYQFGCHAJYOJ-UHFFFAOYSA-N

• 1-N-Boc-Pyrrolidine-3-Acetic Acid
IUPAC Name: 2-[(3R)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-3-yl]acetate | CAS Registry Number: 175526-97-3
Synonyms: ZINC01420822

Molecular Formula: C11H18NO4-Molecular Weight: 228.264920 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: SKEXQIJIXQSFRX-MRVPVSSYSA-M

• 1,2,3,4-Tetrahydroisoquinoline-7-Carbonitrile Hydrochloride
IUPAC Name: 1,2,3,4-tetrahydroisoquinoline-7-carbonitrile;hydrochloride | CAS Registry Number: 200137-81-1
Synonyms: 1,2,3,4-TETRAHYDROISOQUINOLINE-7-CARBONITRILE HYDROCHLORIDE, SureCN65520, CTK8B7420, MolPort-003-985-368, ANW-57253, AKOS016001525, AK-44578, KB-09942, T80026, 1,2,3,4-Tetrahydro-isoquinoline-7-carbonitrile HCl

Molecular Formula: C10H11ClN2Molecular Weight: 194.660740 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: NPCOFDGYVBVRLW-UHFFFAOYSA-N

• 1-Cbz-3-Piperidinecarboxaldehyde
IUPAC Name: benzyl (3S)-3-formylpiperidine-1-carboxylate | CAS Registry Number: 201478-72-0
Synonyms: ZINC02577450

Molecular Formula: C14H17NO3Molecular Weight: 247.289680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: QKGTVOXHDCVOAW-ZDUSSCGKSA-N

• 4-Nitro-Pyrazole
IUPAC Name: 4-nitro-1H-pyrazole | CAS Registry Number: 2075-46-9
Synonyms: 4-Nitropyrazole, 4-Nitro-1H-pyrazole, 1H-Pyrazole, 4-nitro-, PYRAZOLE, 4-NITRO-, ZINC01049761, ALBB-004465, CID16376, ZERO/009309, STK263689, LS-128546, AF-625/00306041, A2533/0107753

Molecular Formula: C3H3N3O2Molecular Weight: 113.074820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: XORHNJQEWQGXCN-UHFFFAOYSA-N

• 5-Fluoro-1,2,3,4-Tetrahydro-Isoquinoline Hydrochloride
IUPAC Name: 5-fluoro-1,2,3,4-tetrahydroisoquinoline;hydrochloride | CAS Registry Number: 799274-07-0
Synonyms: 5-fluoro-1,2,3,4-tetrahydroisoquinoline hydrochloride, 5-FLUORO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE HYDROCHLORIDE, SureCN1124513, CTK8C5038, MolPort-003-985-415, ACT10836, ANW-73818, AKOS016004489, RP24756, AK-30479, KB-43138, A19988, 5-FLUORO-1,2,3,4-TETRAHYDROISOQUINOLINE HCL

Molecular Formula: C9H11ClFNMolecular Weight: 187.641743 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: PMDNGEMGKNMLCE-UHFFFAOYSA-N

• 3-Amino-1-Boc-pyrrolidine
IUPAC Name: tert-butyl 3-aminopyrrolidine-1-carboxylate | CAS Registry Number: 186550-13-0
Synonyms: 1-Boc-3-aminopyrrolidine, C-3153

Molecular Formula: C9H18N2O2Molecular Weight: 186.251420 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: CMIBWIAICVBURI-UHFFFAOYSA-N

• 4 Cap
IUPAC Name: 2-amino-4-chlorophenol | CAS Registry Number: 95-85-2
Synonyms: Fouramine PY, 2-Amino-4-chlorophenol, p-Chloro-o-aminophenol, 4-Chloro-2-aminophenol, 2-Hydroxy-5-chloroaniline, 5-CHLORO-2-HYDROXYANILINE, C.I. Oxidation Base 18, Phenol, 2-amino-4-chloro-, CCRIS 4579, C44400_ALDRICH, EINECS 202-458-9, CID7265, UN2673, AIDS019916, NSC 247814, AIDS-019916, BRN 0774859, NSC247814, SBB007588, ZINC00404323

Molecular Formula: C6H6ClNOMolecular Weight: 143.570940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: SWFNPENEBHAHEB-UHFFFAOYSA-N

• 2-Amino-4-chloropyrimidine
IUPAC Name: 4-chloropyrimidin-2-amine | CAS Registry Number: 3993-78-0
Synonyms: 4-Chloro-2-pyrimidinamine, 4-Chloro-2-aminopyrimidine, 661325_ALDRICH, AIDS020789, AIDS-020789, NSC10872, NSC25184, CID223332, TL8002886, AC-907/30002014

Molecular Formula: C4H4ClN3Molecular Weight: 129.547660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DBGFGNCFYUNXLD-UHFFFAOYSA-N

• 4-Amino-2-Chloropyrimidine
IUPAC Name: 2-chloropyrimidin-4-amine | CAS Registry Number: 7461-50-9
Synonyms: Ambap6218, 2-Chloro-4-pyrimidinamine, 2-Chloro-4-aminopyrimidine, 4-Amino-2-chloropyrimidine, 2-chloropyrimidin-4-ylamine, NSC403512, CID345752, ZINC01595944, TL8005132, AC-907/30002015

Molecular Formula: C4H4ClN3Molecular Weight: 129.547660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: LPBDZVNGCNTELM-UHFFFAOYSA-N

• 2-Carboxybenzaldehyde
IUPAC Name: 2-formylbenzoic acid | CAS Registry Number: 119-67-5
Synonyms: o-Formylbenzoic acid, 2-Formylbenzoic acid, o-Carboxybenzaldehyde, PHTHALALDEHYDIC ACID, Benzoic acid, 2-formyl-, NSC 5045, CHEBI:17605, EINECS 204-342-3, NSC5045, BRN 0742381, LS-109067, ST5208675, C03057, 4-10-00-02748 (Beilstein Handbook Reference)

Molecular Formula: C8H6O3Molecular Weight: 150.131440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DYNFCHNNOHNJFG-UHFFFAOYSA-N

• (R)-1-N-Boc-3-(hydroxymethyl)piperidine
IUPAC Name: tert-butyl (3R)-3-(hydroxymethyl)piperidine-1-carboxylate | CAS Registry Number: 140695-85-8
Synonyms: (R)-1-Boc-3-(Hydroxymethyl)Piperidine, (R)-N-Boc-3-hydroxymethyl piperidine, (R)-1-Boc-3-(hyroxymethyl)piperidine, (R)-N-Boc-3-Piperidinemethanol, 1-Boc-3-Hyroxymethyl-Piperidine, AG-D-81470, (R)-N-Boc-3-(hydroxymethyl)piperidine, tert-butyl (3R)-3-(hydroxymethyl)piperidine-1-carboxylate, (3R)-1-(tert-Butoxycarbonyl)-3-(hydroxymethyl)piperidine, TERT-BUTYL (R)-3-HYDROXYMETHYLPIPERIDINE-1-CARBOXYLATE, PubChem11317, PubChem11323, AC1LTTJ1, BOC-R-PIP-3MEOH, SureCN344916, (R)-BOC-NIP-OL, AC1Q1N1X, KSC522G1J, Jsp002418, (s)-tert-butyl 3-(hydroxymethyl)tetrahydro-1(2h)-pyridinecarboxylate

Molecular Formula: C11H21NO3Molecular Weight: 215.289340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: OJCLHERKFHHUTB-SECBINFHSA-N

• 3,6-Dihydro-2H-pyridine-1-N-Boc-4-boronic acid pinacol ester
IUPAC Name: tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate | CAS Registry Number: 286961-14-6
Synonyms: N-Boc-1,2,5,6-tetrahydropyridine-4-boronic acid pinacol ester, tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-5,6-dihydropyridine-1(2H)-carboxylate, 1-N-BOC-4-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)-3,6-DIHYDRO-2H-PYRIDINE, 1-Boc-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine, N-Boc-1,2,3,6-tetrahydropyridine-4-boronic acid pinacol ester, 3,6-DIHYDRO-2H-PYRIDINE-1-N-BOC-4-BORONIC ACID PINACOL ESTER, 1,2,3,6-Tetrahydropyridine-4-boronic acid, pinacol ester, N-BOC protected, (N-tert-Butoxycarbonyl)-1,2,3,6-tetrahydropyridine-4-boronic acid pinacol ester, tert-butyl 4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate, 4-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester, tert-butyl 1-Boc-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2,3,6-tetrahydropyridine, tert-Butyl 3,6-dihydro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-1(2H)-carboxylate, tert-Butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2,3,6-tetrahydropyridine-1-carboxylate, AC1NEGYO, PubChem17433, PubChem23415, SureCN39349, ACMC-20c49v, KSC680Q6L, CTK5I0865

Molecular Formula: C16H28BNO4Molecular Weight: 309.208820 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: VVDCRJGWILREQH-UHFFFAOYSA-N

• 9,10-Dihydro-9-oxoacridine
IUPAC Name: 10H-acridin-9-one | CAS Registry Number: 578-95-0
Synonyms: acridone, Acridanone, 9-Acridanone, 9-Acridone, Acridin-9-one, 9(10H)-ACRIDINONE, 9-Acridinol, 9(10H)-Acridone, acridin-9(10H)-one, 10H-acridin-9-one, 9(10H)-Acridanone, 7H-Dibenz(a,j)acrid-14-one, CCRIS 3317, Acridine, 9,10-dihydro-9-oxo-, MLS000551242, 150215_ALDRICH, ARONIS001302, 01670_FLUKA, CHEBI:50756, EINECS 209-434-7

Molecular Formula: C13H9NOMolecular Weight: 195.216660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: FZEYVTFCMJSGMP-UHFFFAOYSA-N

• 1,2,3,4-Tetrahydroisoquinoline-6-Carbonitrile Hydrochloride
IUPAC Name: 1,2,3,4-tetrahydroisoquinoline-6-carbonitrile;hydrochloride | CAS Registry Number: 171084-93-8
Synonyms: 1,2,3,4-TETRAHYDROISOQUINOLINE-6-CARBONITRILE HYDROCHLORIDE, 1,2,3,4-Tetrahydroisoquinoline-6-CarbonitrileHydrochloride, PubChem17098, SureCN4224148, CTK8C4441, MolPort-003-985-448, ANW-71960, AKOS015910683, MB05619, AK-60390, FT-0687590, 6-CYANO-1,2,3,4-TETRAHYDROISOQUINOLINE HCL, I14-40325, 1,2,3,4-TETRAHYDROISOQUINOLINE-6-CARBONITRILE HCL, 6-CYANO-1,2,3,4-TETRAHYDROISOQUINOLINE HYDROCHLORIDE, 6-ISOQUINOLINECARBONITRILE, 1,2,3,4-TETRAHYDRO-, HYDROCHLORIDE

Molecular Formula: C10H11ClN2Molecular Weight: 194.660740 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: FYJDPVBTMLJVDX-UHFFFAOYSA-N

• 5-(trifluoromethyl)-1,2,3,4-Tetrahydroisoquinoline Hydrochloride
IUPAC Name: 5-(trifluoromethyl)-1,2,3,4-tetrahydroisoquinoline;hydrochloride | CAS Registry Number: 215788-34-4
Synonyms: 5-(TRIFLUOROMETHYL)-1,2,3,4-TETRAHYDROISOQUINOLINE hydrochloride, 5-TRIFLUOROMETHYL-1,2,3,4-TETRAHYDROISOQUINOLINE, SureCN2260124, CTK8E1473, QC-7291, AK142076, KB-73083, 5-TRIFLUOROMETHYL-1,2,3,4-TETRAHYDROISOQUINOLINE HCL, 5-Trifluoromethyl-1,2,3,4-tetrahydro-isoquinoline hydrochloride

Molecular Formula: C10H11ClF3NMolecular Weight: 237.649250 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: ALVOQWQWCNJRBR-UHFFFAOYSA-N

• 1,2,3,4-Tetrahydroisoquinoline-5-Carbonitrile
IUPAC Name: 1,2,3,4-tetrahydroisoquinoline-5-carbonitrile | CAS Registry Number: 215794-24-4
Synonyms: 1,2,3,4-TETRAHYDRO-ISOQUINOLINE-5-CARBONITRILE, 1,2,3,4-Tetrahydroisoquinoline-5-carbonitrile, AG-E-58134, AGN-PC-00VAGR, SureCN1010480, MolPort-002-499-451, ANW-75171, ZINC12650530, AKOS006343493, AB32479, AK-34109, KB-09939, A4638, A13057, 5-CYANO-1,2,3,4-TETRAHYDROISOQUINOLINE, S14-2504, 1,2,3,4-TETRAHYDRO-5-ISOQUINOLINECARBONITRILE, 5-ISOQUINOLINECARBONITRILE, 1,2,3,4-TETRAHYDRO-, 5-Cyanoisoquinoline;Isoquinoline-5-carbonitrile;Cyanoisoquinoline;MFCD03109890;

Molecular Formula: C10H10N2Molecular Weight: 158.199800 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: BTLCQUCMNTUJNV-UHFFFAOYSA-N

• 1-Cbz-Piperazine
IUPAC Name: benzyl piperazin-4-ium-1-carboxylate | CAS Registry Number: 31166-44-6
Synonyms: ZINC04977160, CID7438997

Molecular Formula: C12H17N2O2+Molecular Weight: 221.275580 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: CTOUWUYDDUSBQE-UHFFFAOYSA-O

• 3-Cyano-Piperidine Hydrochloride
IUPAC Name: piperidine-3-carbonitrile;hydrochloride | CAS Registry Number: 828300-57-8
Synonyms: PIPERIDINE-3-CARBONITRILE HYDROCHLORIDE, PIPERIDINE-3-CARBONITRILE HCL, 1199773-75-5, SureCN1972662, CTK8B6553, MolPort-020-001-557, ANW-53650, 3-piperidinecarbonitrile hydrochloride, AKOS006230700, PB31344, 3-CYANO-PIPERIDINE HYDROCHLORIDE, AK-84454, KB-59739, FT-0692260, W8644, C-8843, A840456

Molecular Formula: C6H11ClN2Molecular Weight: 146.617940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: UGNVDGLCOHDISF-UHFFFAOYSA-N

• 4-Amino-1-Naphthol hydrochloride
IUPAC Name: (4-hydroxynaphthalen-1-yl)azanium chloride | CAS Registry Number: 5959-56-8
Synonyms: NSC 7943, 1-Amino-4-naphthol hydrochloride, 4-Amino-1-naphthol hydrochloride, EINECS 227-727-8, CID22245, 1-Naphthalenol, 4-amino-, hydrochloride, 1-NAPHTHOL, 4-AMINO-, HYDROCHLORIDE, LS-95409

Molecular Formula: C10H10ClNOMolecular Weight: 195.645500 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: FDBQTRARWCKEJY-UHFFFAOYSA-N

• 4-N-Boc-2-methylpiperazine
IUPAC Name: tert-butyl 3-methylpiperazine-1-carboxylate | CAS Registry Number: 120737-59-9
Synonyms: 4-n-boc-2-methyl-piperazine, Tert-butyl 3-methylpiperazine-1-carboxylate, 4-boc-2-methyl-piperazine, 1-boc-3-methylpiperazine, 2-methylpiperazine, n4-boc protected, 1-boc-3-methyl-piperazine, 2-methyl-4-boc-piperazine, 4-boc-2-methyl piperazine, n-1-boc-3-methylpiperazine, N-1-Boc-3-methyl piperizine, tert-Butyl 3-methyl-1-piperazinecarboxylate, (+/-)-n4-boc-2-methylpiperazine, SBB056121, 3-methyl-piperazine-1-carboxylic acid tert-butyl ester, 3-methylpiperazine-1-carboxylic acid tert-butyl ester, (S)-2-Methyl-1-Boc-piperazine, PubChem9403, AC1MBUF7, 4-boc-2-methylpiperazine, SureCN16018

Molecular Formula: C10H20N2O2Molecular Weight: 200.278000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: FMLPQHJYUZTHQS-UHFFFAOYSA-N

• 2-Indanone
IUPAC Name: 1,3-dihydroinden-2-one | CAS Registry Number: 615-13-4
Synonyms: 2-INDANONE, Indan-2-one, beta-Hydrindone, 1,3-Dihydro-2H-inden-2-one, 2INDANONE, 2H-Inden-2-one, 1,3-dihydro-, 146692_ALDRICH, CHEBI:27930, EINECS 210-410-3, CID11983, BRN 0636550, c0402, ZINC00897211, AI3-39163, LS-81313, C07727, TL80073601, 4-07-00-01002 (Beilstein Handbook Reference), T5573157, InChI=1/C9H8O/c10-9-5-7-3-1-2-4-8(7)6-9/h1-4H,5-6H

Molecular Formula: C9H8OMolecular Weight: 132.159220 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: UMJJFEIKYGFCAT-UHFFFAOYSA-N

• (R)-1-Boc-3-(aminomethyl) piperidine
IUPAC Name: tert-butyl 3-(aminomethyl)piperidine-1-carboxylate | CAS Registry Number: 140645-23-4
Synonyms: ALBB-006382, SBB011302, (R)-1-Boc-3-(aminomethyl)piperidine, BAS 10155807, FS011279, tert-butyl 3-(aminomethyl)piperidine-1-carboxylate, 3-Aminomethyl-piperidine-1-carboxylic acid tert-butyl ester, 162167-97-7

Molecular Formula: C11H22N2O2Molecular Weight: 214.304580 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: WPWXYQIMXTUMJB-UHFFFAOYSA-N


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