UCSF

ZINC24227919

Substance Information

In ZINC since Heavy atoms Benign functionality
January 15th, 2009 26 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) 2.47 4.37 -62.61 2 6 1 77 376.454 5
Mid Mid (pH 6-8) 2.47 1.9 -16 1 6 0 76 375.446 5

Activity (Go SEA)

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