UCSF

ZINC30566831

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 31st, 2009 30 Yes

Popular Name: [4-(azepane-1-carbonyl)-1-piperidyl]-(2-phenylsulfanyl-3-pyridyl)methanone [4-(azepane-1-carbonyl)-1-piperi…

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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) 3.63 12.03 -19.29 0 5 0 54 423.582 4 ↓

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