UCSF

ZINC47845164

Substance Information

In ZINC since Heavy atoms Benign functionality
September 7th, 2010 11 Yes

Other Names:

MFCD16547790

MFCD19442716

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) 0.31 3.69 -29.65 3 2 1 30 153.249 1
Mid Mid (pH 6-8) 0.31 3.97 -97.5 4 2 2 32 154.257 1

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

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