UCSF

ZINC34864699

Substance Information

In ZINC since Heavy atoms Benign functionality
September 29th, 2009 35 No

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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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) 3.99 12.7 -22.39 0 8 0 90 484.572 10
Mid Mid (pH 6-8) 3.99 14.89 -67.93 1 8 1 91 485.58 10

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