UCSF

ZINC16951401

Substance Information

In ZINC since Heavy atoms Benign functionality
September 11th, 2008 12 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) -4.31 -3.29 -9.67 2 6 0 93 174.108 0

Activity (Go SEA)

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