UCSF

ZINC40147291

Substance Information

In ZINC since Heavy atoms Benign functionality
March 24th, 2010 33 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) 7.29 16.22 -11.74 1 4 0 66 451.595 8
Mid Mid (pH 6-8) 7.47 14.74 -47.06 0 4 -1 72 450.587 8

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