UCSF

ZINC20552356

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2008 19 No

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) -0.07 1.92 -48.36 4 7 1 93 286.381 3
Hi High (pH 8-9.5) -0.07 -0.24 -12.98 3 7 0 92 285.373 3

Activity (Go SEA)

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