UCSF

ZINC03735125

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2004 14 Yes

Popular Name: 2-(1-methyl-4-piperidinyl)azepane 2-(1-methyl-4-piperidinyl)azepane

Find On: PubMed — Wikipedia — Google

CAS Number: 527674-00-6

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) 2.30 -0.14 -94.41 3 2 2 21 198.354 1 ↓

Activity (Go SEA)

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