UCSF

ZINC36747441

Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2009 17 Yes

Other Names:

MFCD12433416

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) -0.91 -0.78 -51.31 6 5 1 100 236.295 6
Mid Mid (pH 6-8) -0.91 -1.1 -17.22 5 5 0 98 235.287 6

Vendor Notes

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

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