UCSF

ZINC26513156

Substance Information

In ZINC since Heavy atoms Benign functionality
February 7th, 2009 15 Yes

Other Names:

MFCD10689615

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) 2.79 6.23 -30.08 2 2 1 26 228.381 6
Hi High (pH 8-9.5) 2.79 5.34 -2.52 1 2 0 21 227.373 6

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% )

No pre-computed analogs available. Try a structural similarity search.