UCSF

ZINC19904850

Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2008 15 Yes

Other Names:

MFCD11141875

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) 2.40 2.76 -37.16 3 3 1 46 230.715 5
Hi High (pH 8-9.5) 2.40 3.54 -30.31 2 3 0 49 229.707 5

Vendor Notes

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

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