UCSF

ZINC12480318

Substance Information

In ZINC since Heavy atoms Benign functionality
May 16th, 2008 15 Yes

Other Names:

MFCD09737501

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) -0.11 0.31 -50.99 4 3 1 51 207.297 3
Hi High (pH 8-9.5) -0.11 -0.27 -5.53 3 3 0 49 206.289 3

Vendor Notes

Note Type Comments Provided By
MP 59 - 61 Enamine Building Blocks
MP 59...61 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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