UCSF

ZINC19427948

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2008 13 Yes

Other Names:

MFCD09929751

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) 1.45 1.92 -52.32 4 3 1 57 183.275 3
Hi High (pH 8-9.5) 1.45 1.58 -7.12 3 3 0 55 182.267 3

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% )