UCSF

ZINC61824701

Substance Information

In ZINC since Heavy atoms Benign functionality
April 17th, 2011 18 Yes

Other Names:

MFCD17145537

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) 2.46 7.41 -48.92 0 4 -1 66 249.286 6
Lo Low (pH 4.5-6) 2.46 5.43 -12.65 1 4 0 64 250.294 6

Vendor Notes

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

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