UCSF

ZINC41043303

Substance Information

In ZINC since Heavy atoms Benign functionality
April 15th, 2010 11 Yes

Other Names:

MFCD14619800

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) 1.48 3.16 -34.81 2 2 1 20 159.297 5
Hi High (pH 8-9.5) 1.48 4.48 -32.08 2 2 1 16 159.297 5
Mid Mid (pH 6-8) 1.48 5.63 -106.73 3 2 2 21 160.305 5

Vendor Notes

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

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