UCSF

ZINC37504542

Substance Information

In ZINC since Heavy atoms Benign functionality
November 26th, 2009 14 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) -1.22 1.73 -49.32 3 5 1 66 195.246 1

Activity (Go SEA)

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