UCSF

ZINC62591979

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 3rd, 2011 20 Yes

Popular Name: 7-(4-methoxyphenyl)-2-(methylthio)thieno[3,2-d]pyrimidin-4(3H)-one 7-(4-methoxyphenyl)-2-(methylthi…

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CAS Numbers: 1291487-02-9 , [1291487-02-9]

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) 4.46 3.98 -49.83 0 4 -1 58 303.388 3 ↓
Mid Mid (pH 6-8) 4.00 5.9 -10.47 1 4 0 55 304.396 3 ↓

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

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