UCSF

ZINC37994865

Substance Information

In ZINC since Heavy atoms Benign functionality
December 21st, 2009 20 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) -2.05 5.45 -41.67 1 7 0 85 285.344 5
Hi High (pH 8-9.5) -2.05 3.84 -57.48 0 7 -1 84 284.336 5

Activity (Go SEA)

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