UCSF

ZINC15442244

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2008 10 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) -1.41 -1.11 -34.17 0 3 -1 57 181.086 2

Activity (Go SEA)

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