UCSF

ZINC20285937

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2008 20 Yes

Other Names:

MFCD09040730

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) 2.52 9.17 -44.17 3 3 1 45 264.352 4
Mid Mid (pH 6-8) 2.52 9.65 -94.13 4 3 2 47 265.36 4

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% )