UCSF

ZINC31569688

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2009 20 Yes

Popular Name: (1)Benzothieno(2,3-d)pyrimidin-4(3H)-one, 5,6,7,8-tetrahydro-2-((diethylamino)methyl)-; 2-((Diethylamino)methyl)-5,6,7,8-tetrahydro-(1)benzothieno(2,3-d)pyrimidin-4(3H)-one; 2-(Diethylaminomethyl)-4-oxo-3,4,5,6,7,8-hexahydrobenzo(b)thieno(2,3-d)pyrimidine (1)Benzothieno(2,3-d)pyrimidin-4…

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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) 2.58 8.35 -47.39 2 4 1 50 292.428 4 ↓
Hi High (pH 8-9.5) 3.04 7.34 -40.26 1 4 0 53 291.42 4 ↓

Activity (Go SEA)

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