UCSF

ZINC37826990

Substance Information

In ZINC since Heavy atoms Benign functionality
December 2nd, 2009 17 Yes

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) 0.28 3.24 -47.07 3 4 1 51 240.371 6
Mid Mid (pH 6-8) 0.28 5.4 -90.15 4 4 2 52 241.379 6

Activity (Go SEA)

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