UCSF

ZINC22167787

Substance Information

In ZINC since Heavy atoms Benign functionality
December 13th, 2008 16 Yes

Other Names:

MFCD09729675

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 -0.18 -53.06 4 5 1 76 228.268 6
Hi High (pH 8-9.5) -0.22 -0.56 -12.68 3 5 0 74 227.26 6

Vendor Notes

Note Type Comments Provided By
MP 70 - 72 Enamine Building Blocks
MP 70...72 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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