UCSF

ZINC35284824

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2009 19 No

Download: MOL2 SDF SMILES Flexibase

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) 0.53 3.04 -44.91 3 5 1 66 286.714 2
Mid Mid (pH 6-8) 0.53 1.84 -5.28 2 5 0 61 285.706 2

Activity (Go SEA)

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