UCSF

ZINC01641423

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 15 Yes

Popular Name: 1-methyl-2-(2-(1-piperidinyl)ethyl)piperidine; nsc27476 1-methyl-2-(2-(1-piperidinyl)eth…

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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) 2.45 8.98 -94.85 2 2 2 9 212.381 3 ↓
Mid Mid (pH 6-8) 2.45 6.67 -32.95 1 2 1 8 211.373 3 ↓

Activity (Go SEA)

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