UCSF

ZINC42806385

Substance Information

In ZINC since Heavy atoms Benign functionality
May 4th, 2010 41 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) -1.00 0.41 -38.55 7 13 0 207 574.583 9
Hi High (pH 8-9.5) -1.00 -0.82 -58.02 6 13 -1 203 573.575 9

Activity (Go SEA)

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