UCSF

ZINC38340206

Substance Information

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

Other Names:

MFCD06446937

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 2.12 -39.27 3 2 1 31 157.281 2
Mid Mid (pH 6-8) 0.63 3.84 -115.02 4 2 2 32 158.289 2
Mid Mid (pH 6-8) 0.63 3.43 -26.38 3 2 1 30 157.281 2

Vendor Notes

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

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