UCSF

ZINC39947591

Substance Information

In ZINC since Heavy atoms Benign functionality
March 18th, 2010 11 Yes

Other Names:

MFCD14690000

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) 1.09 2.41 -35.98 2 2 1 20 157.281 1
Hi High (pH 8-9.5) 1.09 2.8 -27.61 2 2 1 16 157.281 1
Hi High (pH 8-9.5) 1.09 1.04 -1 1 2 0 15 156.273 1

Vendor Notes

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

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