UCSF

ZINC40053230

Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2010 31 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) 3.04 6.08 -66.37 1 7 -1 103 420.441 7
Mid Mid (pH 6-8) 3.04 5.33 -15.71 2 7 0 100 421.449 7

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