UCSF

ZINC16661257

Substance Information

In ZINC since Heavy atoms Benign functionality
September 3rd, 2008 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) 4.85 8.4 -43.55 0 4 -1 53 335.408 6
Ref Reference (pH 7) 5.34 8.98 -8.69 1 4 0 54 336.416 5

Activity (Go SEA)

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