UCSF

ZINC40182814

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2010 23 Yes

Download: MOL2 SDF SMILES Flexibase

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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) 3.36 10.91 -12.71 0 4 0 38 311.429 6
Mid Mid (pH 6-8) 3.36 11.41 -36.74 1 4 1 39 312.437 6

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