UCSF

ZINC38021883

Substance Information

In ZINC since Heavy atoms Benign functionality
December 21st, 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) -0.85 3.24 -41.04 2 6 0 83 232.28 9
Hi High (pH 8-9.5) -0.85 1.38 -51.3 1 6 -1 82 231.272 9

Activity (Go SEA)

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