UCSF

ZINC12183080

Substance Information

In ZINC since Heavy atoms Benign functionality
April 4th, 2008 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) 1.71 -0.38 -11 1 6 0 65 287.319 3

Activity (Go SEA)

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