UCSF

ZINC19259637

Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2008 18 Yes

Other Names:

MFCD09742030

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) 1.07 3.93 -55.34 3 4 1 59 245.302 5
Lo Low (pH 4.5-6) 1.07 4.36 -91.58 4 4 2 60 246.31 5

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% )