UCSF

ZINC06603156

Substance Information

In ZINC since Heavy atoms Benign functionality
April 9th, 2006 24 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) 4.00 6.75 -43.23 0 4 -1 54 356.448 6
Lo Low (pH 4.5-6) 3.54 8.53 -14.17 1 4 0 51 357.456 6

Activity (Go SEA)

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