UCSF

ZINC37790510

Substance Information

In ZINC since Heavy atoms Benign functionality
December 1st, 2009 18 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) 1.15 6.1 -44.38 2 5 1 51 273.788 8
Hi High (pH 8-9.5) 1.15 3.98 -10.79 1 5 0 50 272.78 8

Activity (Go SEA)

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