UCSF

ZINC38339224

Substance Information

In ZINC since Heavy atoms Benign functionality
January 15th, 2010 30 No

CAS Number: 135889-00-8

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) -0.21 1.8 -65.52 5 11 -1 181 452.494 8

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