UCSF

ZINC15011734

Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 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) 5.51 9.5 -7.56 1 3 0 45 348.349 3
Ref Reference (pH 7) 5.02 8.97 -37.12 0 3 -1 44 347.341 4

Activity (Go SEA)

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