UCSF

ZINC22066957

Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2008 12 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) -1.69 -8.37 -13.63 4 5 0 90 196.224 1
Hi High (pH 8-9.5) -1.69 -7.9 -51.38 4 5 -1 90 195.216 1

Activity (Go SEA)

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