UCSF

ZINC36714951

Substance Information

In ZINC since Heavy atoms Benign functionality
November 12th, 2009 35 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) 4.98 8.17 -17.05 0 8 0 73 520.051 9
Mid Mid (pH 6-8) 4.98 10.39 -56.41 1 8 1 75 521.059 9

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