UCSF

ZINC04215263

Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2005 32 No

CAS Numbers: 82547-58-8 , [82547-58-8]

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) -1.85 4.34 -64.93 3 14 -1 194 478.496 7

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