UCSF

ZINC09232665

Substance Information

In ZINC since Heavy atoms Benign functionality
August 15th, 2007 37 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) 3.62 9.97 -19.35 0 11 0 123 505.483 7
Ref Reference (pH 7) 3.62 10.71 -11.01 0 11 0 123 505.483 7

Activity (Go SEA)

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