UCSF

ZINC22141348

Substance Information

In ZINC since Heavy atoms Benign functionality
December 13th, 2008 19 Yes

Other Names:

MFCD09047482

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) -0.48 6.7 -68.1 3 6 0 99 265.313 5
Mid Mid (pH 6-8) -0.48 5.73 -61.77 2 6 -1 98 264.305 5

Vendor Notes

Note Type Comments Provided By
MP 127 - 129 Enamine Building Blocks
MP 127...129 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

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