UCSF

ZINC26505312

Substance Information

In ZINC since Heavy atoms Benign functionality
February 7th, 2009 19 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) 2.19 4.86 -17.46 1 4 0 51 296.417 1
Hi High (pH 8-9.5) 2.19 4.19 -45.73 0 4 -1 50 295.409 1

Activity (Go SEA)

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