UCSF

ZINC20285885

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2008 12 Yes

Other Names:

MFCD09040716

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) -0.22 2.68 -46.88 3 2 1 37 170.207 3
Hi High (pH 8-9.5) -0.22 2.37 -3.74 2 2 0 35 169.199 3

Vendor Notes

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

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