UCSF

ZINC22921689

Substance Information

In ZINC since Heavy atoms Benign functionality
December 22nd, 2008 15 Yes

Other Names:

MFCD09702290

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) 1.99 5.01 -34.07 2 2 1 20 205.325 2
Lo Low (pH 4.5-6) 1.99 7.11 -109.93 3 2 2 21 206.333 2
Lo Low (pH 4.5-6) 1.99 5.91 -31.19 2 2 1 16 205.325 2

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% )