UCSF

ZINC33826937

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2009 12 Yes

Popular Name: 4-Piperidinecarboxylic acid, 4-amino-, ethyl ester, ethanedioate (1:2); Dioxalate de l'amino-4 isonipecotate d'ethyle [French]; Ethyl 4-amino-4-piperidinecarboxylate ethanedioate (1:2); LS-114620 4-Piperidinecarboxylic acid, 4-a…

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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) -0.14 1.06 -47.56 4 4 1 69 173.236 3 ↓
Lo Low (pH 4.5-6) -0.14 1.31 -120.36 5 4 2 71 174.244 3 ↓

Activity (Go SEA)

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