UCSF

ZINC40845525

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2010 17 Yes

Popular Name: N-(4-phenylbutyl)piperidin-4-amine N-(4-phenylbutyl)piperidin-4-amine

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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) 2.52 6.42 -38.01 3 2 1 29 233.379 6 ↓
Mid Mid (pH 6-8) 2.52 6.27 -39.51 3 2 1 29 233.379 6 ↓
Mid Mid (pH 6-8) 2.52 7.61 -106.51 4 2 2 33 234.387 6 ↓

Activity (Go SEA)

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