UCSF

ZINC49547330

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2010 27 Yes

Popular Name: N-(3-methylsulfanylphenyl)-2-[6-(morpholinomethyl)-4-oxo-pyran-3-yl]oxy-acetamide N-(3-methylsulfanylphenyl)-2-[6-…

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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) 0.91 5.79 -25.96 1 7 0 81 390.461 7 ↓
Lo Low (pH 4.5-6) 0.91 8.08 -69.03 2 7 1 82 391.469 7 ↓

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

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