UCSF

ZINC06524906

Substance Information

In ZINC since Heavy atoms Benign functionality
April 5th, 2006 12 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) 0.74 -1.94 -10.24 2 4 0 66 162.148 0
Hi High (pH 8-9.5) 0.74 -1.04 -46.49 1 4 -1 69 161.14 0

Activity (Go SEA)

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