UCSF

ZINC36154275

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 26 Yes

Popular Name: 5-(3,4-dimethoxyphenyl)-2-[(isobutylamino)methyl]-3H-thieno[2,3-d]pyrimidin-4-one 5-(3,4-dimethoxyphenyl)-2-[(isob…

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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) 2.90 7.29 -58.8 3 6 1 81 374.486 7 ↓
Hi High (pH 8-9.5) 3.36 4.96 -46.77 2 6 0 84 373.478 7 ↓
Hi High (pH 8-9.5) 2.90 5.93 -13.51 2 6 0 76 373.478 7 ↓

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