UCSF

ZINC16973878

Substance Information

In ZINC since Heavy atoms Benign functionality
September 11th, 2008 18 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) 2.10 9.42 -7.92 1 6 0 69 250.302 5

Activity (Go SEA)

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