UCSF

ZINC57218685

Substance Information

In ZINC since Heavy atoms Benign functionality
January 17th, 2011 16 Yes

Other Names:

MFCD01452348

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) 2.03 6.33 -35.48 2 2 1 16 223.315 3
Mid Mid (pH 6-8) 2.03 5.14 -36.17 2 2 1 20 223.315 3

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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Analogs ( Draw Identity 99% 90% 80% 70% )