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ZINC Item

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19989083

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2-amino-4,6-dichloro-phenyl)-2-(3,6-dioxo-2H-pyridazin-1-yl)acetamide N-(2-amino-4,6-dichloro-phenyl)-…

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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	0.86	-46	3	7	-1	113	328.135	3	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	1.54	-0.24	-22.16	4	7	0	110	329.143	3	↓ MOL2 SDF SMILES Flexibase

61401540

Analogs

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Popular Name: N-(4-amino-2,6-dichloro-phenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(4-amino-2,6-dichloro-phenyl)-…

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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)	1.23	3.34	-17.87	3	6	0	90	313.144	3	↓ MOL2 SDF SMILES Flexibase

61401631

Analogs

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Popular Name: N-(3-amino-4-methyl-phenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(3-amino-4-methyl-phenyl)-2-(6…

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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)	0.80	2.72	-18.46	3	6	0	90	258.281	3	↓ MOL2 SDF SMILES Flexibase

61401633

Analogs

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Popular Name: N-(2-amino-4-methyl-phenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(2-amino-4-methyl-phenyl)-2-(6…

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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)	0.80	2.91	-18.29	3	6	0	90	258.281	3	↓ MOL2 SDF SMILES Flexibase

61401637

Analogs

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Popular Name: N-(4-amino-2-bromo-phenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(4-amino-2-bromo-phenyl)-2-(6-…

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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)	0.75	2.72	-16.46	3	6	0	90	323.15	3	↓ MOL2 SDF SMILES Flexibase

61401647

Analogs

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Popular Name: N-(2-amino-5-fluoro-phenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(2-amino-5-fluoro-phenyl)-2-(6…

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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)	0.52	2.3	-21.28	3	6	0	90	262.244	3	↓ MOL2 SDF SMILES Flexibase

61401650

Analogs

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Popular Name: N-(5-amino-2-chloro-phenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(5-amino-2-chloro-phenyl)-2-(6…

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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)	0.62	2.58	-16.65	3	6	0	90	278.699	3	↓ MOL2 SDF SMILES Flexibase

61401655

Analogs

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Popular Name: N-(4-aminophenyl)-N-methyl-2-(6-oxopyridazin-1-yl)acetamide N-(4-aminophenyl)-N-methyl-2-(6-…

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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)	0.26	3.63	-19.31	2	6	0	81	258.281	3	↓ MOL2 SDF SMILES Flexibase

61401659

Analogs

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Popular Name: N-(2-amino-6-methyl-phenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(2-amino-6-methyl-phenyl)-2-(6…

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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)	0.78	2.9	-17.68	3	6	0	90	258.281	3	↓ MOL2 SDF SMILES Flexibase

61401686

Analogs

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Popular Name: N-(4-amino-2-methoxy-phenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(4-amino-2-methoxy-phenyl)-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)	0.00	1.37	-18.37	3	7	0	99	274.28	4	↓ MOL2 SDF SMILES Flexibase

61401696

Analogs

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Popular Name: N-(3-aminophenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(3-aminophenyl)-2-(6-oxopyrida…

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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)	-0.01	1.94	-18.12	3	6	0	90	244.254	3	↓ MOL2 SDF SMILES Flexibase

61401701

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2-amino-4-chloro-phenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(2-amino-4-chloro-phenyl)-2-(6…

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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)	1.03	2.76	-17.94	3	6	0	90	278.699	3	↓ MOL2 SDF SMILES Flexibase

61401705

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-aminophenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(4-aminophenyl)-2-(6-oxopyrida…

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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)	0.02	1.95	-18.45	3	6	0	90	244.254	3	↓ MOL2 SDF SMILES Flexibase

61401708

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(3-amino-4-chloro-phenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(3-amino-4-chloro-phenyl)-2-(6…

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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)	1.03	2.54	-17.34	3	6	0	90	278.699	3	↓ MOL2 SDF SMILES Flexibase

61401710

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2-aminophenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(2-aminophenyl)-2-(6-oxopyrida…

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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)	0.38	2.24	-18.17	3	6	0	90	244.254	3	↓ MOL2 SDF SMILES Flexibase

61401713

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-amino-2-chloro-phenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(4-amino-2-chloro-phenyl)-2-(6…

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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)	0.62	2.58	-16.57	3	6	0	90	278.699	3	↓ MOL2 SDF SMILES Flexibase

61401719

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(5-amino-2-methyl-phenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(5-amino-2-methyl-phenyl)-2-(6…

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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)	0.39	2.84	-18.24	3	6	0	90	258.281	3	↓ MOL2 SDF SMILES Flexibase

61401725

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-amino-2-methyl-phenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(4-amino-2-methyl-phenyl)-2-(6…

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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)	0.39	2.83	-18.74	3	6	0	90	258.281	3	↓ MOL2 SDF SMILES Flexibase

61401727

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2-amino-4-fluoro-phenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(2-amino-4-fluoro-phenyl)-2-(6…

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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)	0.52	2.3	-18.4	3	6	0	90	262.244	3	↓ MOL2 SDF SMILES Flexibase

61401731

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2-amino-5-chloro-phenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(2-amino-5-chloro-phenyl)-2-(6…

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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)	1.03	2.75	-19.94	3	6	0	90	278.699	3	↓ MOL2 SDF SMILES Flexibase

61401739

Analogs

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Popular Name: N-(3-amino-2-methyl-phenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(3-amino-2-methyl-phenyl)-2-(6…

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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)	0.78	2.94	-18.87	3	6	0	90	258.281	3	↓ MOL2 SDF SMILES Flexibase

61401770

Analogs

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Popular Name: N-(5-amino-2-methoxy-phenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(5-amino-2-methoxy-phenyl)-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)	0.00	1.36	-18.11	3	7	0	99	274.28	4	↓ MOL2 SDF SMILES Flexibase

61401773

Analogs

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Popular Name: N-(5-amino-2-fluoro-phenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(5-amino-2-fluoro-phenyl)-2-(6…

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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)	0.11	2.05	-17.38	3	6	0	90	262.244	3	↓ MOL2 SDF SMILES Flexibase

61401782

Analogs

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Popular Name: N-(3-amino-4-fluoro-phenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(3-amino-4-fluoro-phenyl)-2-(6…

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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)	0.52	2.04	-17.98	3	6	0	90	262.244	3	↓ MOL2 SDF SMILES Flexibase

61401786

Analogs

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Popular Name: N-(2-amino-4-methoxy-phenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(2-amino-4-methoxy-phenyl)-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)	0.41	1.52	-18.92	3	7	0	99	274.28	4	↓ MOL2 SDF SMILES Flexibase

61401807

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2-amino-4,6-dichloro-phenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(2-amino-4,6-dichloro-phenyl)-…

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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	3.47	-15.77	3	6	0	90	313.144	3	↓ MOL2 SDF SMILES Flexibase

61401972

Analogs

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Popular Name: 4-chloro-3-[[2-(6-oxopyridazin-1-yl)acetyl]amino]benzoic 4-chloro-3-[[2-(6-oxopyridazin-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)	1.46	5.27	-64.18	1	7	-1	104	306.685	4	↓ MOL2 SDF SMILES Flexibase

61403113

Analogs

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Popular Name: N-(4-cyanophenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(4-cyanophenyl)-2-(6-oxopyrida…

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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)	0.70	4.48	-19.45	1	6	0	88	254.249	3	↓ MOL2 SDF SMILES Flexibase

61403124

Analogs

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Popular Name: N-(3-cyanophenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(3-cyanophenyl)-2-(6-oxopyrida…

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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)	0.67	4.46	-21.24	1	6	0	88	254.249	3	↓ MOL2 SDF SMILES Flexibase

61403179

Analogs

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Popular Name: N-(2-carbamothioylphenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(2-carbamothioylphenyl)-2-(6-o…

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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)	0.69	3.81	-25.31	3	6	0	90	288.332	4	↓ MOL2 SDF SMILES Flexibase

61403184

Analogs

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Popular Name: N-(3-carbamothioylphenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(3-carbamothioylphenyl)-2-(6-o…

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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)	0.72	3.29	-31.05	3	6	0	90	288.332	4	↓ MOL2 SDF SMILES Flexibase

61403188

Analogs

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Popular Name: N-(4-carbamothioylphenyl)-2-(6-oxopyridazin-1-yl)acetamide N-(4-carbamothioylphenyl)-2-(6-o…

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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)	0.74	3.31	-27.45	3	6	0	90	288.332	4	↓ MOL2 SDF SMILES Flexibase

14251300

Analogs

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Popular Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-(5-cyano-3,4-dimethyl-6-oxo-pyridazin-1-yl)acetamide N-(4-chloro-2-methoxy-5-methyl-p…

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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)	2.26	6.1	-18.79	1	7	0	97	360.801	4	↓ MOL2 SDF SMILES Flexibase

3590963

Analogs

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Popular Name: 2-(4,5-dichloro-6-keto-pyridazin-1-yl)-N-methyl-N-phenyl-acetamide 2-(4,5-dichloro-6-keto-pyridazin…

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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)	2.40	1.18	-15.17	0	5	0	55	312.156	3	↓ MOL2 SDF SMILES Flexibase

3590966

Analogs

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Popular Name: 2-(4,5-dichloro-6-keto-pyridazin-1-yl)-N-(2,3-dimethylphenyl)acetamide 2-(4,5-dichloro-6-keto-pyridazin…

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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)	2.95	0.36	-15.16	1	5	0	63	326.183	3	↓ MOL2 SDF SMILES Flexibase

3590968

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4,5-dichloro-6-keto-pyridazin-1-yl)-N-p-cumenyl-acetamide 2-(4,5-dichloro-6-keto-pyridazin…

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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)	3.66	6.96	-14.16	1	5	0	64	340.21	4	↓ MOL2 SDF SMILES Flexibase

3590973

Analogs

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Popular Name: 2-(4,5-dichloro-6-keto-pyridazin-1-yl)-N-(3-methoxyphenyl)acetamide 2-(4,5-dichloro-6-keto-pyridazin…

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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)	2.19	-0.4	-15.03	1	6	0	73	328.155	4	↓ MOL2 SDF SMILES Flexibase

3590975

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4,5-dichloro-6-keto-pyridazin-1-yl)-N-(2,5-dimethoxyphenyl)acetamide 2-(4,5-dichloro-6-keto-pyridazin…

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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)	2.19	-0.27	-16.94	1	7	0	82	358.181	5	↓ MOL2 SDF SMILES Flexibase

3590976

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4,5-dichloro-6-keto-pyridazin-1-yl)-N-(o-tolyl)acetamide 2-(4,5-dichloro-6-keto-pyridazin…

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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)	2.55	0.13	-15.03	1	5	0	63	312.156	3	↓ MOL2 SDF SMILES Flexibase

3590978

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4,5-dichloro-6-keto-pyridazin-1-yl)-N-(p-tolyl)acetamide 2-(4,5-dichloro-6-keto-pyridazin…

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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	5.7	-16.59	1	5	0	64	312.156	3	↓ MOL2 SDF SMILES Flexibase

3590981

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4,5-dichloro-6-keto-pyridazin-1-yl)-N-(4-methoxyphenyl)acetamide 2-(4,5-dichloro-6-keto-pyridazin…

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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)	2.21	-0.39	-16.14	1	6	0	73	328.155	4	↓ MOL2 SDF SMILES Flexibase

3590991

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4,5-dichloro-6-keto-pyridazin-1-yl)-N-o-phenetyl-acetamide 2-(4,5-dichloro-6-keto-pyridazin…

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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)	2.54	-0.25	-13.81	1	6	0	73	342.182	5	↓ MOL2 SDF SMILES Flexibase

3590992

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4,5-dichloro-6-keto-pyridazin-1-yl)-N-[4-(diethylsulfamoyl)phenyl]acetamide 2-(4,5-dichloro-6-keto-pyridazin…

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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)	2.22	-4.03	-21.23	1	8	0	101	433.317	7	↓ MOL2 SDF SMILES Flexibase

3590995

Analogs

3464852

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4,5-dichloro-6-keto-pyridazin-1-yl)-N-(3,5-dimethylphenyl)acetamide 2-(4,5-dichloro-6-keto-pyridazin…

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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)	2.98	0.23	-14.61	1	5	0	63	326.183	3	↓ MOL2 SDF SMILES Flexibase

3590998

Analogs

6500972

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4,5-dichloro-6-keto-pyridazin-1-yl)-N-(2,6-diethylphenyl)acetamide 2-(4,5-dichloro-6-keto-pyridazin…

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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)	2.95	0.95	-14.14	1	5	0	63	354.237	5	↓ MOL2 SDF SMILES Flexibase

3591008

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4,5-dichloro-6-keto-pyridazin-1-yl)-N-(2,4-dimethylphenyl)acetamide 2-(4,5-dichloro-6-keto-pyridazin…

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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)	2.98	0.46	-15.07	1	5	0	63	326.183	3	↓ MOL2 SDF SMILES Flexibase

3591011

Analogs

3430284
3430287

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4,5-dichloro-6-keto-pyridazin-1-yl)-N-(2-methoxyphenyl)acetamide 2-(4,5-dichloro-6-keto-pyridazin…

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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)	2.16	-0.27	-14.25	1	6	0	73	328.155	4	↓ MOL2 SDF SMILES Flexibase

3591012

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4,5-dichloro-6-keto-pyridazin-1-yl)-N-(2-isopropyl-6-methyl-phenyl)acetamide 2-(4,5-dichloro-6-keto-pyridazin…

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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)	2.61	1.27	-14.12	1	5	0	63	354.237	4	↓ MOL2 SDF SMILES Flexibase

3591013

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4,5-dichloro-6-keto-pyridazin-1-yl)-N-mesityl-acetamide 2-(4,5-dichloro-6-keto-pyridazin…

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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	0.9	-14.23	1	5	0	63	340.21	3	↓ MOL2 SDF SMILES Flexibase

3591042

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4,5-dichloro-6-keto-pyridazin-1-yl)-N-(3,5-dimethoxyphenyl)acetamide 2-(4,5-dichloro-6-keto-pyridazin…

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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)	2.19	3.65	-17.55	1	7	0	82	358.181	5	↓ MOL2 SDF SMILES Flexibase

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