UCSF

ZINC06567537

Substance Information

In ZINC since Heavy atoms Benign functionality
April 7th, 2006 16 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) -0.02 5.17 -33.03 4 4 0 84 330.125 3
Hi High (pH 8-9.5) -0.02 4.85 -43.53 3 4 -1 82 329.117 3

Activity (Go SEA)

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