UCSF

ZINC35277143

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2009 34 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) 2.30 6.68 -63.43 0 9 -1 107 470.498 11
Lo Low (pH 4.5-6) 2.30 5.93 -20.53 1 9 0 104 471.506 11

Activity (Go SEA)

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