UCSF

ZINC42820913

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 4th, 2010 21 Yes

Popular Name: 5,6-dimethyl-2-[[[(2R)-tetrahydropyran-2-yl]methylamino]methyl]-1H-thieno[2,3-d]pyrimidin-4-one 5,6-dimethyl-2-[[[(2R)-tetrahydr…

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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) 1.89 3.8 -19.31 2 5 0 67 307.419 4 ↓
Hi High (pH 8-9.5) 2.34 3.19 -47.02 2 5 0 75 307.419 4 ↓
Lo Low (pH 4.5-6) 1.89 5.17 -58.22 3 5 1 72 308.427 4 ↓

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