UCSF

ZINC19441311

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2008 14 Yes

Other Names:

MFCD09934667

MFCD16817411

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) 2.37 3.95 -5.93 3 3 0 55 211.627 1
Lo Low (pH 4.5-6) 2.37 3.9 -32.08 4 3 1 56 212.635 1

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% )