UCSF

ZINC20285703

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2008 16 Yes

Other Names:

MFCD09040646

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) 3.11 5.24 -31.86 2 2 1 16 217.336 2
Mid Mid (pH 6-8) 3.11 6.68 -101.35 3 2 2 21 218.344 2

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% )