UCSF

ZINC39883770

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 26 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 3.44 9.66 -13.54 0 4 0 37 348.446 4
Mid Mid (pH 6-8) 3.44 11.88 -53.73 1 4 1 38 349.454 4

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