UCSF

ZINC02383467

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2004 19 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) 5.66 -0.24 -6.12 1 4 0 55 309.187 5
Hi High (pH 8-9.5) 5.66 0.34 -27.97 0 4 -1 57 308.179 5

Activity (Go SEA)

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