UCSF

ZINC19911853

Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2008 15 Yes

Other Names:

MFCD11143169

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) 3.05 5.62 -38.33 2 2 1 20 213.389 6
Lo Low (pH 4.5-6) 3.05 7.98 -103.98 3 2 2 21 214.397 6

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% )