UCSF

ZINC35349229

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2009 24 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) -1.38 -3.06 -20.02 1 11 0 139 363.348 4
Hi High (pH 8-9.5) -0.92 -5.72 -57.47 0 11 -1 142 362.34 4

Activity (Go SEA)

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