UCSF

ZINC36637242

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2009 28 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 1.35 7.24 -63.17 2 9 1 97 402.504 6
Mid Mid (pH 6-8) 1.35 4.9 -19.1 1 9 0 96 401.496 6

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