UCSF

ZINC09273607

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2007 30 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 0.24 -18.98 0 4 0 46 433.602 7
Lo Low (pH 4.5-6) 4.54 0.35 -49.86 1 4 1 47 434.61 7

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