UCSF

ZINC09304933

Substance Information

In ZINC since Heavy atoms Benign functionality
August 17th, 2007 35 Yes

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) 2.57 -0.54 -21.2 2 10 0 124 497.577 12

Activity (Go SEA)

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