UCSF

ZINC52872119

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2010 22 Yes

Popular Name: 2-[(diisopentylamino)methyl]-3H-thieno[3,2-d]pyrimidin-4-one 2-[(diisopentylamino)methyl]-3H-…

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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) 4.42 7.25 -45.76 1 4 0 53 321.49 8 ↓
Mid Mid (pH 6-8) 3.96 9.85 -49.96 2 4 1 50 322.498 8 ↓

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

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