UCSF

ZINC07673534

Substance Information

In ZINC since Heavy atoms Benign functionality
June 11th, 2006 28 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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) 4.54 9.79 -16.84 2 5 0 75 413.568 4
Hi High (pH 8-9.5) 5.00 8.42 -49.27 1 5 -1 78 412.56 4

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