UCSF

ZINC34668226

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2009 27 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) 3.33 8.54 -46.44 2 6 1 59 390.891 7
Mid Mid (pH 6-8) 3.33 6.32 -8.26 1 6 0 58 389.883 7

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