UCSF

ZINC09281428

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2007 39 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) 5.87 14.12 -13.1 0 8 0 78 530.621 11
Ref Reference (pH 7) 5.87 14.05 -10.17 0 8 0 78 530.621 11

Activity (Go SEA)

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