UCSF

ZINC26516846

Substance Information

In ZINC since Heavy atoms Benign functionality
February 7th, 2009 14 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) -0.24 2.5 -43.9 3 5 1 72 201.246 6
Hi High (pH 8-9.5) -0.24 1.25 -15.51 2 5 0 67 200.238 6

Activity (Go SEA)

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