UCSF

ZINC05353621

Substance Information

In ZINC since Heavy atoms Benign functionality
January 30th, 2006 28 Yes

CAS Numbers: 2389-49-3 , 84559-78-4

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) 5.06 7.33 -15.72 2 8 0 103 394.468 13

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