UCSF

ZINC26186131

Substance Information

In ZINC since Heavy atoms Benign functionality
February 4th, 2009 20 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) -0.96 -2.1 -47.94 6 7 1 118 303.408 7
Hi High (pH 8-9.5) -0.96 -3.39 -14.1 5 7 0 113 302.4 7

Activity (Go SEA)

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