UCSF

ZINC39963912

Substance Information

In ZINC since Heavy atoms Benign functionality
March 19th, 2010 30 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) 3.02 8.96 -49.23 1 8 1 77 429.932 5
Mid Mid (pH 6-8) 3.02 6.74 -11.69 0 8 0 76 428.924 5

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