UCSF

ZINC08416666

Substance Information

In ZINC since Heavy atoms Benign functionality
July 14th, 2006 21 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) 2.76 0.55 -6.54 0 3 0 39 295.411 1

Activity (Go SEA)

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