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ZINC Item

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59416509

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-ethyl-2-(2-hexoxythieno[3,2-b]thiophen-5-yl)pyrimidine 5-ethyl-2-(2-hexoxythieno[3,2-b]…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	6.34	11.07	-6.98	0	3	0	35	346.521	8	↓ MOL2 SDF SMILES Flexibase

59416511

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(5-ethoxythieno[3,2-b]thiophen-2-yl)-5-ethyl-pyrimidine 2-(5-ethoxythieno[3,2-b]thiophen…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.26	7.93	-7.42	0	3	0	35	290.413	4	↓ MOL2 SDF SMILES Flexibase

59416523

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-propyl-2-(2-undecoxythieno[3,2-b]thiophen-5-yl)pyrimidine 5-propyl-2-(2-undecoxythieno[3,2…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	8.81	15.76	-6.72	0	3	0	35	430.683	14	↓ MOL2 SDF SMILES Flexibase

59416529

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-butyl-2-(2-nonoxythieno[3,2-b]thiophen-5-yl)pyrimidine 5-butyl-2-(2-nonoxythieno[3,2-b]…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	8.59	14.98	-6.8	0	3	0	35	416.656	13	↓ MOL2 SDF SMILES Flexibase

59416546

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-ethyl-2-(5-methoxythieno[3,2-b]thiophen-2-yl)pyrimidine 5-ethyl-2-(5-methoxythieno[3,2-b…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.89	6.99	-7.81	0	3	0	35	276.386	3	↓ MOL2 SDF SMILES Flexibase

59416552

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-butyl-2-(2-dodecoxythieno[3,2-b]thiophen-5-yl)pyrimidine 5-butyl-2-(2-dodecoxythieno[3,2-…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	9.20	17.32	-6.8	0	3	0	35	458.737	16	↓ MOL2 SDF SMILES Flexibase

59416557

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-octoxythieno[3,2-b]thiophen-5-yl)-5-pentyl-pyrimidine 2-(2-octoxythieno[3,2-b]thiophen…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	8.59	14.98	-6.86	0	3	0	35	416.656	13	↓ MOL2 SDF SMILES Flexibase

59416560

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-hexyl-2-(5-methoxythieno[3,2-b]thiophen-2-yl)pyrimidine 5-hexyl-2-(5-methoxythieno[3,2-b…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.85	10.11	-7.67	0	3	0	35	332.494	7	↓ MOL2 SDF SMILES Flexibase

59416574

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-heptyl-2-(2-nonoxythieno[3,2-b]thiophen-5-yl)pyrimidine 5-heptyl-2-(2-nonoxythieno[3,2-b…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	9.20	17.32	-6.74	0	3	0	35	458.737	16	↓ MOL2 SDF SMILES Flexibase

59416579

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-ethyl-2-(2-heptylthieno[3,2-b]thiophen-5-yl)pyrimidine 5-ethyl-2-(2-heptylthieno[3,2-b]…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	7.08	13.01	-7.54	0	2	0	26	344.549	8	↓ MOL2 SDF SMILES Flexibase

59416595

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-hexyl-2-(5-pentylthieno[3,2-b]thiophen-2-yl)pyrimidine 5-hexyl-2-(5-pentylthieno[3,2-b]…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	8.03	14.57	-7.32	0	2	0	26	372.603	10	↓ MOL2 SDF SMILES Flexibase

59416599

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-decoxythieno[3,2-b]thiophen-5-yl)-5-pentyl-pyrimidine 2-(2-decoxythieno[3,2-b]thiophen…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	9.03	16.54	-6.8	0	3	0	35	444.71	15	↓ MOL2 SDF SMILES Flexibase

59416604

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-hexyl-2-(2-octoxythieno[3,2-b]thiophen-5-yl)pyrimidine 5-hexyl-2-(2-octoxythieno[3,2-b]…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	8.84	15.76	-6.89	0	3	0	35	430.683	14	↓ MOL2 SDF SMILES Flexibase

59416612

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-decoxythieno[3,2-b]thiophen-5-yl)-5-hexyl-pyrimidine 2-(2-decoxythieno[3,2-b]thiophen…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	9.20	17.32	-6.84	0	3	0	35	458.737	16	↓ MOL2 SDF SMILES Flexibase

59416617

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-nonoxythieno[3,2-b]thiophen-5-yl)-5-propyl-pyrimidine 2-(2-nonoxythieno[3,2-b]thiophen…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	8.22	14.19	-6.72	0	3	0	35	402.629	12	↓ MOL2 SDF SMILES Flexibase

59416623

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-butyl-2-(2-undecoxythieno[3,2-b]thiophen-5-yl)pyrimidine 5-butyl-2-(2-undecoxythieno[3,2-…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	9.03	16.54	-6.79	0	3	0	35	444.71	15	↓ MOL2 SDF SMILES Flexibase

59416636

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-decoxythieno[3,2-b]thiophen-5-yl)-5-propyl-pyrimidine 2-(2-decoxythieno[3,2-b]thiophen…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	8.56	14.98	-6.75	0	3	0	35	416.656	13	↓ MOL2 SDF SMILES Flexibase

59416640

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-heptyl-2-(5-pentylthieno[3,2-b]thiophen-2-yl)pyrimidine 5-heptyl-2-(5-pentylthieno[3,2-b…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	8.43	15.35	-7.32	0	2	0	26	386.63	11	↓ MOL2 SDF SMILES Flexibase

59416641

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-dodecoxythieno[3,2-b]thiophen-5-yl)-5-propyl-pyrimidine 2-(2-dodecoxythieno[3,2-b]thioph…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	9.02	16.54	-6.71	0	3	0	35	444.71	15	↓ MOL2 SDF SMILES Flexibase

59416648

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-butyl-2-(5-methoxythieno[3,2-b]thiophen-2-yl)pyrimidine 5-butyl-2-(5-methoxythieno[3,2-b…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.84	8.55	-7.63	0	3	0	35	304.44	5	↓ MOL2 SDF SMILES Flexibase

59416659

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(5-hexoxythieno[3,2-b]thiophen-2-yl)-5-hexyl-pyrimidine 2-(5-hexoxythieno[3,2-b]thiophen…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	8.26	14.19	-6.86	0	3	0	35	402.629	12	↓ MOL2 SDF SMILES Flexibase

59416660

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(5-ethoxythieno[3,2-b]thiophen-2-yl)-5-hexyl-pyrimidine 2-(5-ethoxythieno[3,2-b]thiophen…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	6.22	11.05	-7.29	0	3	0	35	346.521	8	↓ MOL2 SDF SMILES Flexibase

59416662

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-nonoxythieno[3,2-b]thiophen-5-yl)-5-pentyl-pyrimidine 2-(2-nonoxythieno[3,2-b]thiophen…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	8.84	15.76	-6.78	0	3	0	35	430.683	14	↓ MOL2 SDF SMILES Flexibase

59416667

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-heptyl-2-(2-octoxythieno[3,2-b]thiophen-5-yl)pyrimidine 5-heptyl-2-(2-octoxythieno[3,2-b…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	9.03	16.54	-6.82	0	3	0	35	444.71	15	↓ MOL2 SDF SMILES Flexibase

59416675

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-decoxythieno[3,2-b]thiophen-5-yl)-5-ethyl-pyrimidine 2-(2-decoxythieno[3,2-b]thiophen…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	8.31	14.2	-6.97	0	3	0	35	402.629	12	↓ MOL2 SDF SMILES Flexibase

59416685

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-pentylthieno[3,2-b]thiophen-5-yl)-5-propyl-pyrimidine 2-(2-pentylthieno[3,2-b]thiophen…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	6.46	12.22	-7.3	0	2	0	26	330.522	7	↓ MOL2 SDF SMILES Flexibase

59416689

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-decoxythieno[3,2-b]thiophen-5-yl)-5-heptyl-pyrimidine 2-(2-decoxythieno[3,2-b]thiophen…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	9.34	18.1	-6.76	0	3	0	35	472.764	17	↓ MOL2 SDF SMILES Flexibase

59416697

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-nonyl-2-(5-pentylthieno[3,2-b]thiophen-2-yl)pyrimidine 5-nonyl-2-(5-pentylthieno[3,2-b]…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	8.93	16.91	-7.32	0	2	0	26	414.684	13	↓ MOL2 SDF SMILES Flexibase

59416700

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-butyl-2-(5-propylthieno[3,2-b]thiophen-2-yl)pyrimidine 5-butyl-2-(5-propylthieno[3,2-b]…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.96	11.44	-7.31	0	2	0	26	316.495	6	↓ MOL2 SDF SMILES Flexibase

59416704

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(5-butoxythieno[3,2-b]thiophen-2-yl)-5-butyl-pyrimidine 2-(5-butoxythieno[3,2-b]thiophen…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	6.28	11.07	-6.84	0	3	0	35	346.521	8	↓ MOL2 SDF SMILES Flexibase

59416705

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-heptylthieno[3,2-b]thiophen-5-yl)-5-hexyl-pyrimidine 2-(2-heptylthieno[3,2-b]thiophen…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	8.71	16.13	-7.34	0	2	0	26	400.657	12	↓ MOL2 SDF SMILES Flexibase

59416707

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-octoxythieno[3,2-b]thiophen-5-yl)-5-propyl-pyrimidine 2-(2-octoxythieno[3,2-b]thiophen…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	7.74	13.41	-6.79	0	3	0	35	388.602	11	↓ MOL2 SDF SMILES Flexibase

59416718

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(5-hexylpyrimidin-2-yl)thieno[3,2-b]thiophene-5-carbonitrile 2-(5-hexylpyrimidin-2-yl)thieno[…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.66	11.21	-6.82	0	3	0	50	327.478	6	↓ MOL2 SDF SMILES Flexibase

59416720

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-ethyl-2-(2-octoxythieno[3,2-b]thiophen-5-yl)pyrimidine 5-ethyl-2-(2-octoxythieno[3,2-b]…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	7.35	12.63	-7.02	0	3	0	35	374.575	10	↓ MOL2 SDF SMILES Flexibase

59416735

Analogs

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Popular Name: 2-(5-heptylpyrimidin-2-yl)thieno[3,2-b]thiophene-5-carbonitrile 2-(5-heptylpyrimidin-2-yl)thieno…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	6.17	11.99	-6.85	0	3	0	50	341.505	7	↓ MOL2 SDF SMILES Flexibase

59416740

Analogs

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Popular Name: 5-hexyl-2-(2-nonoxythieno[3,2-b]thiophen-5-yl)pyrimidine 5-hexyl-2-(2-nonoxythieno[3,2-b]…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	9.03	16.54	-6.81	0	3	0	35	444.71	15	↓ MOL2 SDF SMILES Flexibase

59416743

Analogs

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Popular Name: 2-(2-hexoxythieno[3,2-b]thiophen-5-yl)-5-propyl-pyrimidine 2-(2-hexoxythieno[3,2-b]thiophen…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	6.73	11.85	-6.77	0	3	0	35	360.548	9	↓ MOL2 SDF SMILES Flexibase

59416747

Analogs

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Popular Name: 5-ethyl-2-(2-undecoxythieno[3,2-b]thiophen-5-yl)pyrimidine 5-ethyl-2-(2-undecoxythieno[3,2-…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	8.62	14.98	-6.94	0	3	0	35	416.656	13	↓ MOL2 SDF SMILES Flexibase

59416750

Analogs

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Popular Name: 2-(5-ethylpyrimidin-2-yl)thieno[3,2-b]thiophene-5-carbonitrile 2-(5-ethylpyrimidin-2-yl)thieno[…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.70	8.09	-6.95	0	3	0	50	271.37	2	↓ MOL2 SDF SMILES Flexibase

59416751

Analogs

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Popular Name: 2-(5-ethoxythieno[3,2-b]thiophen-2-yl)-5-propyl-pyrimidine 2-(5-ethoxythieno[3,2-b]thiophen…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.66	8.71	-7.26	0	3	0	35	304.44	5	↓ MOL2 SDF SMILES Flexibase

59416776

Analogs

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Popular Name: 5-butyl-2-(2-pentylthieno[3,2-b]thiophen-5-yl)pyrimidine 5-butyl-2-(2-pentylthieno[3,2-b]…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	7.02	13.01	-7.35	0	2	0	26	344.549	8	↓ MOL2 SDF SMILES Flexibase

59416779

Analogs

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Popular Name: 5-ethyl-2-(2-propylthieno[3,2-b]thiophen-5-yl)pyrimidine 5-ethyl-2-(2-propylthieno[3,2-b]…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.00	9.88	-7.55	0	2	0	26	288.441	4	↓ MOL2 SDF SMILES Flexibase

59416780

Analogs

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Popular Name: 2-(2-heptylthieno[3,2-b]thiophen-5-yl)-5-pentyl-pyrimidine 2-(2-heptylthieno[3,2-b]thiophen…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	8.43	15.35	-7.3	0	2	0	26	386.63	11	↓ MOL2 SDF SMILES Flexibase

59416781

Analogs

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Popular Name: 2-(5-ethoxythieno[3,2-b]thiophen-2-yl)-5-heptyl-pyrimidine 2-(5-ethoxythieno[3,2-b]thiophen…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	6.73	11.83	-7.24	0	3	0	35	360.548	9	↓ MOL2 SDF SMILES Flexibase

59416782

Analogs

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Popular Name: 5-heptyl-2-(5-hexoxythieno[3,2-b]thiophen-2-yl)pyrimidine 5-heptyl-2-(5-hexoxythieno[3,2-b…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	8.59	14.98	-6.8	0	3	0	35	416.656	13	↓ MOL2 SDF SMILES Flexibase

59416785

Analogs

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Popular Name: 2-(2-butoxythieno[3,2-b]thiophen-5-yl)-5-ethyl-pyrimidine 2-(2-butoxythieno[3,2-b]thiophen…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.33	9.51	-7.04	0	3	0	35	318.467	6	↓ MOL2 SDF SMILES Flexibase

59416786

Analogs

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Popular Name: 5-pentyl-2-(5-propylthieno[3,2-b]thiophen-2-yl)pyrimidine 5-pentyl-2-(5-propylthieno[3,2-b…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	6.46	12.23	-7.31	0	2	0	26	330.522	7	↓ MOL2 SDF SMILES Flexibase

59416793

Analogs

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Popular Name: 2-(2-dodecoxythieno[3,2-b]thiophen-5-yl)-5-ethyl-pyrimidine 2-(2-dodecoxythieno[3,2-b]thioph…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	8.86	15.76	-6.92	0	3	0	35	430.683	14	↓ MOL2 SDF SMILES Flexibase

59416794

Analogs

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Popular Name: 5-butyl-2-(2-octoxythieno[3,2-b]thiophen-5-yl)pyrimidine 5-butyl-2-(2-octoxythieno[3,2-b]…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	8.26	14.19	-6.85	0	3	0	35	402.629	12	↓ MOL2 SDF SMILES Flexibase

59416799

Analogs

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Popular Name: 2-(5-butoxythieno[3,2-b]thiophen-2-yl)-5-pentyl-pyrimidine 2-(5-butoxythieno[3,2-b]thiophen…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	6.78	11.85	-6.8	0	3	0	35	360.548	9	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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Structural Results Found: (before additional filtering)

SQL Query Was

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