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ZINC Item

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12537569

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2,5-dichlorophenoxy)-1-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)ethanone 2-(2,5-dichlorophenoxy)-1-(3,4-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)	3.81	8.86	-14.21	0	4	0	42	337.206	3	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	3.81	9.12	-38.77	1	4	1	44	338.214	3	↓ MOL2 SDF SMILES Flexibase

12537967

Analogs

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Popular Name: (4-chlorophenyl)-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)methanone (4-chlorophenyl)-(3,4-dihydro-2H…

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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)	3.23	7.54	-9.58	0	3	0	33	272.735	1	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	3.23	7.8	-35.81	1	3	1	34	273.743	1	↓ MOL2 SDF SMILES Flexibase

12538634

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2,4-dichlorophenoxy)-1-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)ethanone 2-(2,4-dichlorophenoxy)-1-(3,4-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)	3.81	8.84	-16.33	0	4	0	42	337.206	3	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	3.81	9.1	-41.49	1	4	1	44	338.214	3	↓ MOL2 SDF SMILES Flexibase

12538636

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(3,4-dichlorophenyl)-1-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)ethanone 2-(3,4-dichlorophenyl)-1-(3,4-di…

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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)	3.93	9.07	-13.08	0	3	0	33	321.207	2	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	3.93	9.33	-38.56	1	3	1	34	322.215	2	↓ MOL2 SDF SMILES Flexibase

12538638

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,4-dihydro-2H-1,5-naphthyridin-1-yl-(3,5-dimethoxyphenyl)methanone 3,4-dihydro-2H-1,5-naphthyridin-…

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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)	2.59	5.64	-11.42	0	5	0	52	298.342	3	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	2.59	5.9	-36.14	1	5	1	53	299.35	3	↓ MOL2 SDF SMILES Flexibase

12538639

Analogs

34532194

Draw Identity 99% 90% 80% 70%

Popular Name: 3,4-dihydro-2H-1,5-naphthyridin-1-yl-(3-methyl-4-nitro-phenyl)methanone 3,4-dihydro-2H-1,5-naphthyridin-…

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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)	2.89	8.31	-11.68	0	6	0	79	297.314	2	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	2.89	8.57	-41.04	1	6	1	80	298.322	2	↓ MOL2 SDF SMILES Flexibase

12539218

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(3,4-dihydro-2H-1,5-naphthyridine-1-carbonyl)benzonitrile 4-(3,4-dihydro-2H-1,5-naphthyrid…

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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)	2.31	7.42	-12.35	0	4	0	57	263.3	1	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	2.31	7.68	-39.62	1	4	1	58	264.308	1	↓ MOL2 SDF SMILES Flexibase

12539359

Analogs

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Popular Name: 4-(3,4-dihydro-2H-1,5-naphthyridine-1-carbonyl)-N-(2-methoxyphenyl)-N-methyl-benzenesulfonamide 4-(3,4-dihydro-2H-1,5-naphthyrid…

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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)	3.57	7.92	-15.19	0	7	0	80	437.521	5	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	3.57	8.18	-43.38	1	7	1	81	438.529	5	↓ MOL2 SDF SMILES Flexibase

12539454

Analogs

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Popular Name: 3,4-dihydro-2H-1,5-naphthyridin-1-yl-(3-nitrophenyl)methanone 3,4-dihydro-2H-1,5-naphthyridin-…

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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)	2.49	7.69	-17	0	6	0	79	283.287	2	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	2.49	7.95	-44.76	1	6	1	80	284.295	2	↓ MOL2 SDF SMILES Flexibase

12539460

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-chloro-5-(3,4-dihydro-2H-1,5-naphthyridine-1-carbonyl)-N,N-diethyl-benzenesulfonamide 2-chloro-5-(3,4-dihydro-2H-1,5-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)	3.22	7.4	-16.04	0	6	0	71	407.923	5	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	3.22	7.66	-46.64	1	6	1	72	408.931	5	↓ MOL2 SDF SMILES Flexibase

23024493

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,4-dihydro-2H-1,5-naphthyridin-1-yl-(3-pyridyl)methanone 3,4-dihydro-2H-1,5-naphthyridin-…

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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)	1.32	5.11	-9.77	0	4	0	46	239.278	1	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	1.32	5.51	-35.15	1	4	1	47	240.286	1	↓ MOL2 SDF SMILES Flexibase

23024509

Analogs

12555695

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-chlorophenyl)-1-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)ethanone 2-(2-chlorophenyl)-1-(3,4-dihydr…

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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)	3.27	8.54	-11.42	0	3	0	33	286.762	2	↓ MOL2 SDF SMILES Flexibase

23024552

Analogs

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Popular Name: N-[4-(3,4-dihydro-2H-1,5-naphthyridine-1-carbonyl)phenyl]cyclopropanecarboxamide N-[4-(3,4-dihydro-2H-1,5-naphthy…

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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)	2.60	7.53	-15.84	1	5	0	62	321.38	3	↓ MOL2 SDF SMILES Flexibase

23024577

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,4-dihydro-2H-1,5-naphthyridin-1-yl-[4-(methoxymethyl)phenyl]methanone 3,4-dihydro-2H-1,5-naphthyridin-…

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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)	2.51	6.74	-11.64	0	4	0	42	282.343	3	↓ MOL2 SDF SMILES Flexibase

23024581

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,4-dihydro-2H-1,5-naphthyridin-1-yl-(1-indan-5-ylsulfonyl-4-piperidyl)methanone 3,4-dihydro-2H-1,5-naphthyridin-…

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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)	2.97	9.08	-17.73	0	6	0	71	425.554	3	↓ MOL2 SDF SMILES Flexibase

23024584

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-(3,4-dihydro-2H-1,5-naphthyridine-1-carbonyl)-N,N,2,3-tetramethyl-benzenesulfonamide 5-(3,4-dihydro-2H-1,5-naphthyrid…

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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)	2.62	6.12	-19.03	0	6	0	71	373.478	3	↓ MOL2 SDF SMILES Flexibase

23024588

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3,4-difluorophenyl)-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)methanone (3,4-difluorophenyl)-(3,4-dihydr…

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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)	2.81	7.15	-12.16	0	3	0	33	274.27	1	↓ MOL2 SDF SMILES Flexibase

23024595

Analogs

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Popular Name: 3,4-dihydro-2H-1,5-naphthyridin-1-yl-(3-fluoro-4-methoxy-phenyl)methanone 3,4-dihydro-2H-1,5-naphthyridin-…

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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)	2.70	6.43	-14.22	0	4	0	42	286.306	2	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	2.70	6.81	-43.61	1	4	1	44	287.314	2	↓ MOL2 SDF SMILES Flexibase

23024598

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,4-dihydro-2H-1,5-naphthyridin-1-yl-[4-(1,3-dithian-2-yl)phenyl]methanone 3,4-dihydro-2H-1,5-naphthyridin-…

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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)	3.68	10.59	-10.34	0	3	0	33	356.516	2	↓ MOL2 SDF SMILES Flexibase

23024602

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[3-(3,4-dihydro-2H-1,5-naphthyridine-1-carbonyl)phenyl]thiophene-2-carboxamide N-[3-(3,4-dihydro-2H-1,5-naphthy…

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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)	3.32	8.01	-23.48	1	5	0	62	363.442	3	↓ MOL2 SDF SMILES Flexibase

23024606

Analogs

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Popular Name: (3-bromo-4-methoxy-phenyl)-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)methanone (3-bromo-4-methoxy-phenyl)-(3,4-…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.35	7.01	-13.1	0	4	0	42	347.212	2	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	3.35	7.4	-42.2	1	4	1	44	348.22	2	↓ MOL2 SDF SMILES Flexibase

23024623

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [1-(2,5-difluorophenyl)sulfonyl-4-piperidyl]-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)methanone [1-(2,5-difluorophenyl)sulfonyl-…

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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)	2.81	7.15	-17.26	0	6	0	71	421.469	3	↓ MOL2 SDF SMILES Flexibase

23024639

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [4-(3,4-dihydro-2H-1,5-naphthyridine-1-carbonyl)phenyl]methylurea [4-(3,4-dihydro-2H-1,5-naphthyri…

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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)	1.39	3.18	-18.6	3	6	0	88	310.357	3	↓ MOL2 SDF SMILES Flexibase

23024642

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,4-dihydro-2H-1,5-naphthyridin-1-yl-(1-phenylpyrazol-4-yl)methanone 3,4-dihydro-2H-1,5-naphthyridin-…

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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)	2.20	8.2	-12	0	5	0	51	304.353	2	↓ MOL2 SDF SMILES Flexibase

23024657

Analogs

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Popular Name: 3,4-dihydro-2H-1,5-naphthyridin-1-yl-[5-(4-fluorophenyl)-2-furyl]methanone 3,4-dihydro-2H-1,5-naphthyridin-…

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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	9.33	-9.81	0	4	0	46	322.339	2	↓ MOL2 SDF SMILES Flexibase

23024660

Analogs

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Popular Name: [5-(2-chlorophenyl)-2-furyl]-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)methanone [5-(2-chlorophenyl)-2-furyl]-(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)	4.36	9.7	-9.24	0	4	0	46	338.794	2	↓ MOL2 SDF SMILES Flexibase

23024671

Analogs

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Popular Name: 3,4-dihydro-2H-1,5-naphthyridin-1-yl-[1-[(4-fluorophenyl)methyl]-3-methyl-thieno[4,5-d]pyrazol-5-yl] 3,4-dihydro-2H-1,5-naphthyridin-…

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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)	4.29	10.7	-13.76	0	5	0	51	406.486	3	↓ MOL2 SDF SMILES Flexibase

23024674

Analogs

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Popular Name: (3-chlorobenzothiophen-2-yl)-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)methanone (3-chlorobenzothiophen-2-yl)-(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)	4.36	8.93	-11.08	0	3	0	33	328.824	1	↓ MOL2 SDF SMILES Flexibase

23024677

Analogs

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Popular Name: (3-chloro-6-fluoro-benzothiophen-2-yl)-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)methanone (3-chloro-6-fluoro-benzothiophen…

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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)	4.50	8.88	-9.04	0	3	0	33	346.814	1	↓ MOL2 SDF SMILES Flexibase

23024683

Analogs

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Popular Name: tert-butyl tert-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)	3.15	7.4	-14.29	1	6	0	72	367.449	5	↓ MOL2 SDF SMILES Flexibase

23024686

Analogs

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Popular Name: 3,4-dihydro-2H-1,5-naphthyridin-1-yl-(7-fluoro-3-methyl-benzofuran-2-yl)methanone 3,4-dihydro-2H-1,5-naphthyridin-…

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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)	3.61	8.66	-9.68	0	4	0	46	310.328	1	↓ MOL2 SDF SMILES Flexibase

23024690

Analogs

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Popular Name: (E)-1-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one (E)-1-(3,4-dihydro-2H-1,5-naphth…

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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)	2.66	9.74	-14.55	0	5	0	51	330.391	3	↓ MOL2 SDF SMILES Flexibase

23024693

Analogs

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Popular Name: 1-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-3-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]propan-1-one 1-(3,4-dihydro-2H-1,5-naphthyrid…

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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)	2.14	6.59	-13.73	0	6	0	72	340.408	4	↓ MOL2 SDF SMILES Flexibase

23024702

Analogs

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Popular Name: 3-(3,4-dihydro-2H-1,5-naphthyridine-1-carbonyl)-6-methyl-1-[2-(trifluoromethyl)phenyl]pyridazin-4-on 3-(3,4-dihydro-2H-1,5-naphthyrid…

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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)	3.35	10.02	-26.1	0	6	0	68	414.387	3	↓ MOL2 SDF SMILES Flexibase

23024705

Analogs

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Popular Name: 3,4-dihydro-2H-1,5-naphthyridine-1-carbonyl-methyl-BLAHone 3,4-dihydro-2H-1,5-naphthyridine…

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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)	3.23	9.17	-16.49	0	6	0	68	394.5	1	↓ MOL2 SDF SMILES Flexibase

23024708

Analogs

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Popular Name: 5-(3,4-dihydro-2H-1,5-naphthyridine-1-carbonyl)-2-(4-ethoxyphenyl)isoindoline-1,3-dione 5-(3,4-dihydro-2H-1,5-naphthyrid…

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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)	3.82	9.88	-16	0	7	0	82	427.46	4	↓ MOL2 SDF SMILES Flexibase

23024711

Analogs

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Popular Name: (E)-1-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)prop-2-en-1-one (E)-1-(3,4-dihydro-2H-1,5-naphth…

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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)	3.11	10.76	-13.76	0	5	0	51	358.445	3	↓ MOL2 SDF SMILES Flexibase

23024714

Analogs

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Popular Name: 3,4-dihydro-2H-1,5-naphthyridine-1-carbonyl-methyl-BLAHone 3,4-dihydro-2H-1,5-naphthyridine…

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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	8.06	-18.34	0	6	0	68	366.446	1	↓ MOL2 SDF SMILES Flexibase

23024719

Analogs

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Popular Name: 3,4-dihydro-2H-1,5-naphthyridin-1-yl-[2-(p-tolyl)thiazol-4-yl]methanone 3,4-dihydro-2H-1,5-naphthyridin-…

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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)	4.09	9.48	-9.3	0	4	0	46	335.432	2	↓ MOL2 SDF SMILES Flexibase

23024722

Analogs

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Popular Name: 6-(3,4-dihydro-2H-1,5-naphthyridine-1-carbonyl)-2,3-dihydrothiazolo[2,3-b]pyrimidin-5-one 6-(3,4-dihydro-2H-1,5-naphthyrid…

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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)	0.90	5.77	-15.08	0	6	0	68	314.37	1	↓ MOL2 SDF SMILES Flexibase

23024725

Analogs

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Popular Name: 1-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-3-[5-(2-fluorophenyl)-2-furyl]propan-1-one 1-(3,4-dihydro-2H-1,5-naphthyrid…

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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)	3.54	10.89	-12.62	0	4	0	46	350.393	4	↓ MOL2 SDF SMILES Flexibase

23024728

Analogs

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Popular Name: [2-(4-chlorophenyl)thiazol-4-yl]-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)methanone [2-(4-chlorophenyl)thiazol-4-yl]…

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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)	4.32	9.36	-9.3	0	4	0	46	355.85	2	↓ MOL2 SDF SMILES Flexibase

23024730

Analogs

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Popular Name: 3,4-dihydro-2H-1,5-naphthyridin-1-yl-(3-furyl)methanone 3,4-dihydro-2H-1,5-naphthyridin-…

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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	5.14	-12.93	0	4	0	46	228.251	1	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	1.50	5.54	-37.69	1	4	1	48	229.259	1	↓ MOL2 SDF SMILES Flexibase

23024733

Analogs

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Popular Name: 3-[2-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-2-oxo-ethyl]-8-methyl-quinazolin-4-one 3-[2-(3,4-dihydro-2H-1,5-naphthy…

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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	9.31	-21.36	0	6	0	68	334.379	2	↓ MOL2 SDF SMILES Flexibase

23024736

Analogs

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Popular Name: 3,4-dihydro-2H-1,5-naphthyridin-1-yl-(4,5,6,7-tetrahydrobenzothiophen-3-yl)methanone 3,4-dihydro-2H-1,5-naphthyridin-…

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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)	3.32	8.7	-10.27	0	3	0	33	298.411	1	↓ MOL2 SDF SMILES Flexibase

23024739

Analogs

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Popular Name: 2-[3-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-3-oxo-propyl]-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfo 2-[3-(3,4-dihydro-2H-1,5-naphthy…

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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)	1.58	8.01	-20.32	0	8	0	88	441.557	6	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	1.58	8.41	-49.74	1	8	1	90	442.565	6	↓ MOL2 SDF SMILES Flexibase

23024744

Analogs

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Popular Name: 3,4-dihydro-2H-1,5-naphthyridin-1-yl-(5-methyl-1-phenyl-pyrazol-4-yl)methanone 3,4-dihydro-2H-1,5-naphthyridin-…

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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)	2.42	8.5	-11.62	0	5	0	51	318.38	2	↓ MOL2 SDF SMILES Flexibase

23024749

Analogs

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Popular Name: 3-(3-chloro-4-methyl-phenyl)-1-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)propan-1-one 3-(3-chloro-4-methyl-phenyl)-1-(…

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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)	3.55	9.97	-10.38	0	3	0	33	314.816	3	↓ MOL2 SDF SMILES Flexibase

23024752

Analogs

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Popular Name: 1-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)propan-1-one 1-(3,4-dihydro-2H-1,5-naphthyrid…

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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)	3.02	10.89	-18.71	0	6	0	63	385.471	3	↓ MOL2 SDF SMILES Flexibase

23024755

Analogs

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Popular Name: 3,4-dihydro-2H-1,5-naphthyridin-1-yl-(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)methanone 3,4-dihydro-2H-1,5-naphthyridin-…

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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)	3.17	10.63	-12.41	0	5	0	51	344.418	2	↓ MOL2 SDF SMILES Flexibase

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