UCSF

ZINC43404473

Substance Information

In ZINC since Heavy atoms Benign functionality
May 13th, 2010 13 Yes

Other Names:

MFCD16070469

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) 0.45 1.81 -15.41 1 4 0 66 176.175 0
Hi High (pH 8-9.5) 0.91 -0.14 -45.29 0 4 -1 69 175.167 0

Vendor Notes

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

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