UCSF

ZINC26476267

Substance Information

In ZINC since Heavy atoms Benign functionality
February 7th, 2009 16 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) -0.17 0.27 -10.07 4 6 0 101 238.272 1
Hi High (pH 8-9.5) 0.29 -0.68 -48.77 3 6 -1 104 237.264 1

Activity (Go SEA)

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