UCSF

ZINC01495019

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2005 16 Yes

Popular Name: 1-(4-Pyridinylmethyl)piperidine-4-carboxylic acid 1-(4-Pyridinylmethyl)piperidine-…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1171413-31-2 , 1172453-94-9 , 70165-31-0 , 774531-43-0 , [1172453-94-9] , [774531-43-0]

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.47 6.07 -64.99 1 4 0 57 220.272 3 ↓
Lo Low (pH 4.5-6) 0.47 6.35 -111.32 2 4 1 59 221.28 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 190-194° Oakwood Chemical
MP 222 - 224 Enamine Building Blocks
MP 222 - 224° Fluorochem
MP 222-224° Matrix Scientific
MP 222...224 Enamine Building Blocks
MP 223 - 224 Enamine Building Blocks
MP 224 - 224 Enamine Building Blocks
MP 224 - 226 Enamine Building Blocks
MP 271 - 273 Enamine Building Blocks
MP 271...273 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 98% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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Analogs ( Draw Identity 99% 90% 80% 70% )