UCSF

ZINC38609810

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 28 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 3.32 7.95 -12.85 2 8 0 115 376.372 5
Mid Mid (pH 6-8) 3.32 8.73 -49.75 1 8 -1 118 375.364 5

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