UCSF

ZINC37842893

Substance Information

In ZINC since Heavy atoms Benign functionality
December 2nd, 2009 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) 2.02 5.83 -51.39 1 4 1 42 297.872 8
Hi High (pH 8-9.5) 2.02 3.47 -9.85 0 4 0 41 296.864 8

Activity (Go SEA)

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