UCSF

ZINC05932399

Substance Information

In ZINC since Heavy atoms Benign functionality
February 18th, 2006 23 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) 4.11 8.3 -40.28 0 6 -1 90 324.341 4
Hi High (pH 8-9.5) 5.06 6.59 -44.03 0 6 -1 94 324.341 3

Activity (Go SEA)

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