UCSF

ZINC05822293

Substance Information

In ZINC since Heavy atoms Benign functionality
February 15th, 2006 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) -1.72 -0.64 -11.65 2 7 0 102 258.226 4
Hi High (pH 8-9.5) -1.72 0.22 -50.74 1 7 -1 105 257.218 4

Activity (Go SEA)

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