UCSF

ZINC35187826

Substance Information

In ZINC since Heavy atoms Benign functionality
October 4th, 2009 15 Yes

Other Names:

MFCD12179904

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) -0.03 0.63 -8.99 1 4 0 44 212.293 3
Lo Low (pH 4.5-6) -0.03 2.92 -41.71 2 4 1 45 213.301 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% )