UCSF

ZINC07892089

Substance Information

In ZINC since Heavy atoms Benign functionality
June 24th, 2006 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) 4.18 6.73 -10 2 4 0 57 330.185 2
Hi High (pH 8-9.5) 4.64 4.68 -48.45 1 4 -1 60 329.177 2

Activity (Go SEA)

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