UCSF

ZINC23005830

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 23rd, 2008 30 No

Popular Name: N-[2-(diisopropylamino)ethyl]-2-[[4-oxo-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-2-yl]methylsulfanyl] N-[2-(diisopropylamino)ethyl]-2-…

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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) 3.33 9.27 -52.63 3 6 1 79 465.69 10 ↓
Hi High (pH 8-9.5) 3.33 6.33 -26.09 2 6 0 78 464.682 10 ↓
Hi High (pH 8-9.5) 3.79 8.26 -71.5 2 6 0 82 464.682 10 ↓

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