UCSF

ZINC22471638

Substance Information

In ZINC since Heavy atoms Benign functionality
December 16th, 2008 23 Yes

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) 3.52 10.26 -49.12 2 4 1 46 330.477 5
Mid Mid (pH 6-8) 3.52 7.9 -15.26 1 4 0 45 329.469 5

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