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11835555

Analogs

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Popular Name: 7-(2-methoxyethyl)-1,3-dimethyl-2,4-dioxo-N-phenyl-pyrrolo[4,5-e]pyrimidine-6-carboxamide 7-(2-methoxyethyl)-1,3-dimethyl-…

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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)	0.96	0.21	-13.3	1	8	0	87	356.382	5	↓ MOL2 SDF SMILES Flexibase

11835556

Analogs

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Popular Name: N-(3-chloro-4-fluoro-phenyl)-7-(2-methoxyethyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-ca N-(3-chloro-4-fluoro-phenyl)-7-(…

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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)	1.73	0.89	-12.15	1	8	0	87	408.817	5	↓ MOL2 SDF SMILES Flexibase

11835557

Analogs

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Popular Name: N-(2-carbamoylphenyl)-7-(2-methoxyethyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carboxami N-(2-carbamoylphenyl)-7-(2-metho…

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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)	-0.27	-2.55	-14.78	3	10	0	130	399.407	6	↓ MOL2 SDF SMILES Flexibase

11835558

Analogs

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Popular Name: N-(2-chlorophenyl)-7-(2-methoxyethyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carboxamide N-(2-chlorophenyl)-7-(2-methoxye…

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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)	1.59	-0.27	-10.04	1	8	0	87	390.827	5	↓ MOL2 SDF SMILES Flexibase

11835577

Analogs

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Popular Name: N-(4-chlorophenyl)-7-(2-methoxyethyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carboxamide N-(4-chlorophenyl)-7-(2-methoxye…

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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)	1.64	0.1	-13	1	8	0	87	390.827	5	↓ MOL2 SDF SMILES Flexibase

11835598

Analogs

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Popular Name: N-(4-butylphenyl)-7-(2-methoxyethyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carboxamide N-(4-butylphenyl)-7-(2-methoxyet…

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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)	2.83	0.97	-12.99	1	8	0	87	412.49	8	↓ MOL2 SDF SMILES Flexibase

11835599

Analogs

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Popular Name: N-(2,4-dimethoxyphenyl)-7-(2-methoxyethyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carboxa N-(2,4-dimethoxyphenyl)-7-(2-met…

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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)	1.00	-0.14	-11.85	1	10	0	106	416.434	7	↓ MOL2 SDF SMILES Flexibase

11835602

Analogs

16890785

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Popular Name: N-(4-isopropylphenyl)-7-(2-methoxyethyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carboxami N-(4-isopropylphenyl)-7-(2-metho…

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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)	2.47	1.04	-13.01	1	8	0	87	398.463	6	↓ MOL2 SDF SMILES Flexibase

11835604

Analogs

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Popular Name: N-(5-chloro-2-methoxy-phenyl)-7-(2-methoxyethyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-c N-(5-chloro-2-methoxy-phenyl)-7-…

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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)	1.62	0.17	-14.24	1	9	0	97	420.853	6	↓ MOL2 SDF SMILES Flexibase

11835607

Analogs

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Popular Name: N-(2-fluorophenyl)-7-(2-methoxyethyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carboxamide N-(2-fluorophenyl)-7-(2-methoxye…

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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)	1.08	0.49	-10.63	1	8	0	87	374.372	5	↓ MOL2 SDF SMILES Flexibase

11835625

Analogs

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Popular Name: N-ethyl-7-(2-methoxyethyl)-1,3-dimethyl-N-(o-tolyl)-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carboxamide N-ethyl-7-(2-methoxyethyl)-1,3-d…

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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)	1.98	1.89	-10.89	0	8	0	78	398.463	6	↓ MOL2 SDF SMILES Flexibase

11835628

Analogs

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Popular Name: N-(3-fluoro-4-methyl-phenyl)-7-(2-methoxyethyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-ca N-(3-fluoro-4-methyl-phenyl)-7-(…

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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)	1.50	0.73	-11.12	1	8	0	87	388.399	5	↓ MOL2 SDF SMILES Flexibase

11835629

Analogs

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Popular Name: methyl 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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.26	1.24	-12.01	1	10	0	114	414.418	7	↓ MOL2 SDF SMILES Flexibase

11835652

Analogs

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Popular Name: N-(3-acetylphenyl)-7-(2-methoxyethyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carboxamide N-(3-acetylphenyl)-7-(2-methoxye…

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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)	0.84	0.74	-15.56	1	9	0	104	398.419	6	↓ MOL2 SDF SMILES Flexibase

11835655

Analogs

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Popular Name: N-(3-chloro-4-methyl-phenyl)-7-(2-methoxyethyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-ca N-(3-chloro-4-methyl-phenyl)-7-(…

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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)	2.02	-0.12	-10.75	1	8	0	87	404.854	5	↓ MOL2 SDF SMILES Flexibase

11835671

Analogs

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Popular Name: 7-(2-methoxyethyl)-1,3-dimethyl-N-(2-methylsulfanylphenyl)-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carb 7-(2-methoxyethyl)-1,3-dimethyl-…

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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)	1.35	-0.39	-11.02	1	8	0	87	402.476	6	↓ MOL2 SDF SMILES Flexibase

11845120

Analogs

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Popular Name: N-(3-chloro-4-fluoro-phenyl)-7-(3-methoxypropyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-c N-(3-chloro-4-fluoro-phenyl)-7-(…

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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)	2.00	1.02	-15.79	1	8	0	87	422.844	6	↓ MOL2 SDF SMILES Flexibase

11845121

Analogs

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Popular Name: N-(2-carbamoylphenyl)-7-(3-methoxypropyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carboxam N-(2-carbamoylphenyl)-7-(3-metho…

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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)	0.00	-2.45	-16.58	3	10	0	130	413.434	7	↓ MOL2 SDF SMILES Flexibase

11845122

Analogs

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Popular Name: N-(2-chlorophenyl)-7-(3-methoxypropyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carboxamide N-(2-chlorophenyl)-7-(3-methoxyp…

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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)	1.86	-0.17	-11.76	1	8	0	87	404.854	6	↓ MOL2 SDF SMILES Flexibase

11845158

Analogs

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Popular Name: N-(4-butylphenyl)-7-(3-methoxypropyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carboxamide N-(4-butylphenyl)-7-(3-methoxypr…

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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)	3.10	1.09	-16.83	1	8	0	87	426.517	9	↓ MOL2 SDF SMILES Flexibase

11845162

Analogs

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Popular Name: N-(4-isopropylphenyl)-7-(3-methoxypropyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carboxam N-(4-isopropylphenyl)-7-(3-metho…

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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)	2.74	1.17	-16.89	1	8	0	87	412.49	7	↓ MOL2 SDF SMILES Flexibase

11845164

Analogs

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Popular Name: N-(5-chloro-2-methoxy-phenyl)-7-(3-methoxypropyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6- N-(5-chloro-2-methoxy-phenyl)-7-…

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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)	1.89	0.29	-16.42	1	9	0	97	434.88	7	↓ MOL2 SDF SMILES Flexibase

11845167

Analogs

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Popular Name: N-(3-methoxyphenyl)-7-(3-methoxypropyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carboxamid N-(3-methoxyphenyl)-7-(3-methoxy…

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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)	1.26	0.46	-16.34	1	9	0	97	400.435	7	↓ MOL2 SDF SMILES Flexibase

11845169

Analogs

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Popular Name: N-(2-fluorophenyl)-7-(3-methoxypropyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carboxamide N-(2-fluorophenyl)-7-(3-methoxyp…

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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)	1.35	0.59	-12.33	1	8	0	87	388.399	6	↓ MOL2 SDF SMILES Flexibase

11845177

Analogs

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Popular Name: N-(3-chlorophenyl)-7-(3-methoxypropyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carboxamide N-(3-chlorophenyl)-7-(3-methoxyp…

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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)	1.89	-0.34	-13.96	1	8	0	87	404.854	6	↓ MOL2 SDF SMILES Flexibase

11845187

Analogs

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Popular Name: N-(3-fluoro-4-methyl-phenyl)-7-(3-methoxypropyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-c N-(3-fluoro-4-methyl-phenyl)-7-(…

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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)	1.77	0.83	-12.88	1	8	0	87	402.426	6	↓ MOL2 SDF SMILES Flexibase

11845188

Analogs

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Popular Name: methyl 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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.54	1.34	-13.88	1	10	0	114	428.445	8	↓ MOL2 SDF SMILES Flexibase

11845193

Analogs

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Popular Name: N-(3-acetamidophenyl)-7-(3-methoxypropyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carboxam N-(3-acetamidophenyl)-7-(3-metho…

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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)	0.43	-1.31	-19.64	2	10	0	116	427.461	7	↓ MOL2 SDF SMILES Flexibase

11845202

Analogs

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Popular Name: 7-(3-methoxypropyl)-N,1,3-trimethyl-2,4-dioxo-N-phenyl-pyrrolo[4,5-e]pyrimidine-6-carboxamide 7-(3-methoxypropyl)-N,1,3-trimet…

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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)	1.48	0.78	-12.91	0	8	0	78	384.436	6	↓ MOL2 SDF SMILES Flexibase

11845207

Analogs

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Popular Name: N-(2,3-dimethylphenyl)-7-(3-methoxypropyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carboxa N-(2,3-dimethylphenyl)-7-(3-meth…

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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)	2.03	0.59	-12.8	1	8	0	87	398.463	6	↓ MOL2 SDF SMILES Flexibase

11845209

Analogs

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Popular Name: N-(3-acetylphenyl)-7-(3-methoxypropyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carboxamide N-(3-acetylphenyl)-7-(3-methoxyp…

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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)	1.11	0.3	-16.12	1	9	0	104	412.446	7	↓ MOL2 SDF SMILES Flexibase

11845220

Analogs

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Popular Name: N-(2-ethoxyphenyl)-7-(3-methoxypropyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carboxamide N-(2-ethoxyphenyl)-7-(3-methoxyp…

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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)	1.62	-0.04	-12.59	1	9	0	97	414.462	8	↓ MOL2 SDF SMILES Flexibase

11845290

Analogs

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Popular Name: butyl butyl

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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)	3.46	1.79	-13.59	1	9	0	104	440.5	9	↓ MOL2 SDF SMILES Flexibase

11845299

Analogs

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Popular Name: N-(3-chloro-4-methyl-phenyl)-1,3-dimethyl-2,4-dioxo-7-propyl-pyrrolo[4,5-e]pyrimidine-6-carboxamide N-(3-chloro-4-methyl-phenyl)-1,3…

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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)	2.91	0.66	-10.5	1	7	0	78	388.855	4	↓ MOL2 SDF SMILES Flexibase

11845312

Analogs

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Popular Name: N-(3-acetamidophenyl)-1,3-dimethyl-2,4-dioxo-7-propyl-pyrrolo[4,5-e]pyrimidine-6-carboxamide N-(3-acetamidophenyl)-1,3-dimeth…

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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)	1.05	0.04	-22.21	2	9	0	107	397.435	5	↓ MOL2 SDF SMILES Flexibase

11845323

Analogs

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Popular Name: N-(2-fluorophenyl)-1,3-dimethyl-2,4-dioxo-7-propyl-pyrrolo[4,5-e]pyrimidine-6-carboxamide N-(2-fluorophenyl)-1,3-dimethyl-…

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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)	1.97	1.27	-10.57	1	7	0	78	358.373	4	↓ MOL2 SDF SMILES Flexibase

11845329

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Popular Name: N-ethyl-1,3-dimethyl-2,4-dioxo-N-phenyl-7-propyl-pyrrolo[4,5-e]pyrimidine-6-carboxamide N-ethyl-1,3-dimethyl-2,4-dioxo-N…

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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)	2.48	10.33	-10.77	0	7	0	69	368.437	5	↓ MOL2 SDF SMILES Flexibase

11845356

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Popular Name: N-(4-isopropylphenyl)-1,3-dimethyl-2,4-dioxo-7-propyl-pyrrolo[4,5-e]pyrimidine-6-carboxamide N-(4-isopropylphenyl)-1,3-dimeth…

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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)	3.37	1.29	-10.77	1	7	0	78	382.464	5	↓ MOL2 SDF SMILES Flexibase

11845365

Analogs

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Popular Name: N-(3-chloro-4-fluoro-phenyl)-1,3-dimethyl-2,4-dioxo-7-propyl-pyrrolo[4,5-e]pyrimidine-6-carboxamide N-(3-chloro-4-fluoro-phenyl)-1,3…

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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)	2.63	1.7	-14.1	1	7	0	78	392.818	4	↓ MOL2 SDF SMILES Flexibase

11845366

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Popular Name: N-(2-carbamoylphenyl)-1,3-dimethyl-2,4-dioxo-7-propyl-pyrrolo[4,5-e]pyrimidine-6-carboxamide N-(2-carbamoylphenyl)-1,3-dimeth…

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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)	0.63	-1.77	-15.22	3	9	0	121	383.408	5	↓ MOL2 SDF SMILES Flexibase

11845414

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Popular Name: 7-butyl-N-(4-chlorophenyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carboxamide 7-butyl-N-(4-chlorophenyl)-1,3-d…

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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)	3.09	0.46	-11	1	7	0	78	388.855	5	↓ MOL2 SDF SMILES Flexibase

11845416

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Popular Name: 7-butyl-N-(4-methoxyphenyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carboxamide 7-butyl-N-(4-methoxyphenyl)-1,3-…

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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)	2.47	0.62	-12.09	1	8	0	87	384.436	6	↓ MOL2 SDF SMILES Flexibase

11845436

Analogs

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Popular Name: 7-butyl-N-(2,4-dimethoxyphenyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carboxamide 7-butyl-N-(2,4-dimethoxyphenyl)-…

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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)	2.46	0.76	-11.84	1	9	0	97	414.462	7	↓ MOL2 SDF SMILES Flexibase

11845441

Analogs

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Popular Name: 7-butyl-N-(5-chloro-2-methoxy-phenyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carboxamide 7-butyl-N-(5-chloro-2-methoxy-ph…

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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)	3.08	1.09	-15.39	1	8	0	87	418.881	6	↓ MOL2 SDF SMILES Flexibase

11845452

Analogs

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Popular Name: 7-butyl-1,3-dimethyl-2,4-dioxo-N-[3-(trifluoromethyl)phenyl]pyrrolo[4,5-e]pyrimidine-6-carboxamide 7-butyl-1,3-dimethyl-2,4-dioxo-N…

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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)	3.29	2.8	-10.88	1	7	0	78	422.407	6	↓ MOL2 SDF SMILES Flexibase

11845463

Analogs

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Popular Name: 7-butyl-N-(3-fluoro-4-methyl-phenyl)-1,3-dimethyl-2,4-dioxo-pyrrolo[4,5-e]pyrimidine-6-carboxamide 7-butyl-N-(3-fluoro-4-methyl-phe…

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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)	2.96	1.63	-10.91	1	7	0	78	386.427	5	↓ MOL2 SDF SMILES Flexibase

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SQL Query Was

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