UCSF

ZINC20549155

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2008 16 Yes

Other Names:

MFCD11117744

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) -0.63 1.38 -52.9 3 5 1 79 219.268 3
Lo Low (pH 4.5-6) -0.63 1.82 -96.71 4 5 2 81 220.276 3

Vendor Notes

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

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