UCSF

ZINC43411707

Substance Information

In ZINC since Heavy atoms Benign functionality
May 13th, 2010 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) 7.45 14.41 -48.17 0 3 -1 49 331.476 14

Activity (Go SEA)

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