UCSF

ZINC13284236

Substance Information

In ZINC since Heavy atoms Benign functionality
June 14th, 2008 20 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) 1.60 9.02 -8.37 0 5 0 66 279.336 10
Lo Low (pH 4.5-6) 1.60 9.29 -38.8 1 5 1 67 280.344 10

Activity (Go SEA)

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