UCSF

ZINC05685232

Substance Information

In ZINC since Heavy atoms Benign functionality
February 9th, 2006 17 Yes

Other Names:

MFCD01244503

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) 1.33 3.38 -50.46 0 5 -1 79 231.231 5
Lo Low (pH 4.5-6) 1.33 1.41 -14.56 1 5 0 76 232.239 5

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% )