UCSF

ZINC31916348

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2009 14 No

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) 0.86 5.15 -20.32 2 3 0 43 205.286 2
Mid Mid (pH 6-8) 0.86 5.56 -33.45 3 3 1 45 206.294 2

Activity (Go SEA)

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