UCSF

ZINC12505203

Substance Information

In ZINC since Heavy atoms Benign functionality
May 16th, 2008 18 No

Other Names:

MFCD08691215

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) 2.03 8.19 -17.76 1 3 0 30 260.362 3
Mid Mid (pH 6-8) 2.76 7.89 -26.31 1 3 1 28 261.37 3

Vendor Notes

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

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Analogs ( Draw Identity 99% 90% 80% 70% )