UCSF

ZINC36154397

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 28 Yes

Popular Name: 5-(2,4-dimethylphenyl)-2-[(2-morpholinoethylamino)methyl]-3H-thieno[2,3-d]pyrimidin-4-one 5-(2,4-dimethylphenyl)-2-[(2-mor…

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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) 2.83 6.14 -60.68 3 6 1 75 399.54 6 ↓
Hi High (pH 8-9.5) 2.83 4.78 -12.41 2 6 0 70 398.532 6 ↓
Hi High (pH 8-9.5) 3.29 3.76 -47.42 2 6 0 78 398.532 6 ↓
Lo Low (pH 4.5-6) 2.83 7.03 -49.69 3 6 1 71 399.54 6 ↓

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