UCSF

ZINC39500527

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 27th, 2010 18 No

Popular Name: (4aS)-6-methyl-3-[[(2S)-4-methyl-2H-imidazol-2-yl]methyl]-2,4a-dihydrothieno[2,3-d]pyrimidin-4-one (4aS)-6-methyl-3-[[(2S)-4-methyl…

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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) 0.66 1.13 -11.76 0 5 0 57 262.338 2 ↓
Lo Low (pH 4.5-6) 0.66 2.11 -44.67 1 5 1 59 263.346 2 ↓

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

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