ZINC 12

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)	1.55	5.38	-68.33	0	7	-1	103	316.318	2	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	1.55	5.55	-77.69	1	7	0	104	317.326	2	↓ MOL2 SDF SMILES Flexibase

67244893

Analogs

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Popular Name: 4-methylbenzyl 1-(4-methylphenyl)-1H-pyrido[2,3-e][1,3,4]thiadiazine-3-carboxylate 4-methylbenzyl 1-(4-methylphenyl…

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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)	4.21	9.82	-15.84	0	7	0	89	421.478	5	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	4.21	10.12	-45.2	1	7	1	90	422.486	5	↓ MOL2 SDF SMILES Flexibase

67244894

Analogs

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Popular Name: N-(4-ethylphenyl)-1-(4-methylphenyl)-1H-pyrido[2,3-e][1,3,4]thiadiazine-3-carboxamide 4,4-dioxide N-(4-ethylphenyl)-1-(4-methylphe…

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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)	4.03	7.97	-17.45	1	7	0	92	420.494	4	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	4.21	6.23	-63.74	0	7	-1	98	419.486	4	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	4.03	8.28	-47.04	2	7	1	93	421.502	4	↓ MOL2 SDF SMILES Flexibase

67244897

Analogs

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Popular Name: N-(4-ethylbenzyl)-1-(4-methylphenyl)-1H-pyrido[2,3-e][1,3,4]thiadiazine-3-carboxamide 4,4-dioxide N-(4-ethylbenzyl)-1-(4-methylphe…

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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)	3.73	8.09	-16.18	1	7	0	92	434.521	5	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	3.91	5.86	-65.02	0	7	-1	98	433.513	5	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	3.73	8.4	-45.22	2	7	1	93	435.529	5	↓ MOL2 SDF SMILES Flexibase

67244898

Analogs

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Popular Name: 3-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylcarbonyl)-1-(4-methylphenyl)-1H-pyrido[2,3-e][1,3,4]thiadiazine 4,4-dioxide 3-(1,4-dioxa-8-azaspiro[4.5]dec-…

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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)	1.94	5.69	-17.96	0	9	0	101	442.497	2	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	1.94	6.01	-47.68	1	9	1	103	443.505	2	↓ MOL2 SDF SMILES Flexibase

67245728

Analogs

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Popular Name: (1-methyl-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl)-(1-piperidyl)methanone (1-methyl-4,4-dioxo-benzo[e][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)	1.32	3.45	-21.8	0	6	0	70	307.375	1	↓ MOL2 SDF SMILES Flexibase

67245730

Analogs

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Popular Name: azepan-1-yl-(1-isopentyl-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl)methanone azepan-1-yl-(1-isopentyl-4,4-dio…

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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)	3.48	7.5	-20.31	0	6	0	70	377.51	4	↓ MOL2 SDF SMILES Flexibase

67245731

Analogs

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Popular Name: (1-isopropyl-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl)-morpholino-methanone (1-isopropyl-4,4-dioxo-benzo[e][…

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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)	0.93	2.51	-20.98	0	7	0	79	337.401	2	↓ MOL2 SDF SMILES Flexibase

67245733

Analogs

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Popular Name: 6-methyl-4,4-dioxo-1-(p-tolyl)benzo[e][1,3,4]thiadiazine-3-carbonitrile 6-methyl-4,4-dioxo-1-(p-tolyl)be…

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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)	3.42	6	-10.94	0	5	0	74	311.366	1	↓ MOL2 SDF SMILES Flexibase

67245735

Analogs

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Popular Name: 4,4-dioxo-1-(p-tolyl)pyrido[2,3-e][1,3,4]thiadiazine-3-carboxamide 4,4-dioxo-1-(p-tolyl)pyrido[2,3-…

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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)	1.04	1.31	-16.91	2	7	0	106	316.342	2	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	1.35	-0.19	-60.04	1	7	-1	110	315.334	2	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	1.04	1.61	-46.24	3	7	1	107	317.35	2	↓ MOL2 SDF SMILES Flexibase

67245737

Analogs

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Popular Name: N-(cyclopropylmethyl)-4,4-dioxo-1-(p-tolyl)pyrido[2,3-e][1,3,4]thiadiazine-3-carboxamide N-(cyclopropylmethyl)-4,4-dioxo-…

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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)	2.28	5.2	-16.31	1	7	0	92	370.434	4	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	2.28	5.5	-45.46	2	7	1	93	371.442	4	↓ MOL2 SDF SMILES Flexibase

67245740

Analogs

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Popular Name: N-(m-tolylmethyl)-4,4-dioxo-1-(p-tolyl)pyrido[2,3-e][1,3,4]thiadiazine-3-carboxamide N-(m-tolylmethyl)-4,4-dioxo-1-(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)	3.24	7.33	-16.47	1	7	0	92	420.494	4	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	3.42	5.09	-65.3	0	7	-1	98	419.486	4	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	3.24	7.63	-45.33	2	7	1	93	421.502	4	↓ MOL2 SDF SMILES Flexibase

49402458

Analogs

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Popular Name: [6-fluoro-4,4-dioxo-1-(p-tolyl)benzo[e][1,3,4]thiadiazin-3-yl]-morpholino-methanone [6-fluoro-4,4-dioxo-1-(p-tolyl)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)	2.54	5.05	-16.62	0	7	0	79	403.435	2	↓ MOL2 SDF SMILES Flexibase

49402461

Analogs

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Popular Name: 6-fluoro-4,4-dioxo-1-(p-tolyl)-N-[[(2S)-tetrahydrofuran-2-yl]methyl]benzo[e][1,3,4]thiadiazine-3-car 6-fluoro-4,4-dioxo-1-(p-tolyl)-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)	2.83	4.53	-15.88	1	7	0	88	417.462	4	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	3.01	2.32	-62.67	0	7	-1	94	416.454	4	↓ MOL2 SDF SMILES Flexibase

49402464

Analogs

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Popular Name: 6-fluoro-4,4-dioxo-1-(p-tolyl)-N-[[(2R)-tetrahydrofuran-2-yl]methyl]benzo[e][1,3,4]thiadiazine-3-car 6-fluoro-4,4-dioxo-1-(p-tolyl)-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)	2.83	4.56	-15.95	1	7	0	88	417.462	4	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	3.01	2.33	-64.55	0	7	-1	94	416.454	4	↓ MOL2 SDF SMILES Flexibase

49402467

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)	0.68	3.7	-23.61	0	8	0	96	351.384	4	↓ MOL2 SDF SMILES Flexibase

49402470

Analogs

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Popular Name: isopropyl isopropyl

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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)	1.42	5.35	-22.94	0	8	0	96	379.438	5	↓ MOL2 SDF SMILES Flexibase

49402473

Analogs

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Popular Name: (1-benzyl-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl)-pyrrolidin-1-yl-methanone (1-benzyl-4,4-dioxo-benzo[e][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)	2.21	6.44	-24.15	0	6	0	70	369.446	3	↓ MOL2 SDF SMILES Flexibase

49402476

Analogs

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Popular Name: [1-(o-tolylmethyl)-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-pyrrolidin-1-yl-methanone [1-(o-tolylmethyl)-4,4-dioxo-ben…

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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	6.68	-24.22	0	6	0	70	383.473	3	↓ MOL2 SDF SMILES Flexibase

49402479

Analogs

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Popular Name: [1-(m-tolylmethyl)-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-pyrrolidin-1-yl-methanone [1-(m-tolylmethyl)-4,4-dioxo-ben…

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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)	2.64	7.11	-24.17	0	6	0	70	383.473	3	↓ MOL2 SDF SMILES Flexibase

49402482

Analogs

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Popular Name: [4,4-dioxo-1-[(4-vinylphenyl)methyl]benzo[e][1,3,4]thiadiazin-3-yl]-pyrrolidin-1-yl-methanone [4,4-dioxo-1-[(4-vinylphenyl)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)	3.06	7.53	-24.86	0	6	0	70	395.484	4	↓ MOL2 SDF SMILES Flexibase

49402486

Analogs

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Popular Name: [1-[(3-methoxyphenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-pyrrolidin-1-yl-methanone [1-[(3-methoxyphenyl)methyl]-4,4…

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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)	2.25	5.74	-26.77	0	7	0	79	399.472	4	↓ MOL2 SDF SMILES Flexibase

49402489

Analogs

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Popular Name: [1-[(2-fluorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-pyrrolidin-1-yl-methanone [1-[(2-fluorophenyl)methyl]-4,4-…

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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)	2.33	6.34	-22.88	0	6	0	70	387.436	3	↓ MOL2 SDF SMILES Flexibase

49402490

Analogs

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Popular Name: [1-[(3-fluorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-pyrrolidin-1-yl-methanone [1-[(3-fluorophenyl)methyl]-4,4-…

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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)	2.35	6.49	-26.89	0	6	0	70	387.436	3	↓ MOL2 SDF SMILES Flexibase

49402493

Analogs

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Popular Name: [1-[(4-fluorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-pyrrolidin-1-yl-methanone [1-[(4-fluorophenyl)methyl]-4,4-…

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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)	2.38	6.49	-26.4	0	6	0	70	387.436	3	↓ MOL2 SDF SMILES Flexibase

49402496

Analogs

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Popular Name: [1-[(3,5-difluorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-pyrrolidin-1-yl-methanone [1-[(3,5-difluorophenyl)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)	2.47	6.54	-26.18	0	6	0	70	405.426	3	↓ MOL2 SDF SMILES Flexibase

49402499

Analogs

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Popular Name: [1-[(2-chlorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-pyrrolidin-1-yl-methanone [1-[(2-chlorophenyl)methyl]-4,4-…

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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)	2.84	6.52	-22.23	0	6	0	70	403.891	3	↓ MOL2 SDF SMILES Flexibase

49402502

Analogs

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Popular Name: [1-[(3-chlorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-pyrrolidin-1-yl-methanone [1-[(3-chlorophenyl)methyl]-4,4-…

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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)	2.87	6.92	-25.87	0	6	0	70	403.891	3	↓ MOL2 SDF SMILES Flexibase

49402505

Analogs

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Popular Name: [1-[(4-chlorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-pyrrolidin-1-yl-methanone [1-[(4-chlorophenyl)methyl]-4,4-…

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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)	2.89	6.94	-25.54	0	6	0	70	403.891	3	↓ MOL2 SDF SMILES Flexibase

49402509

Analogs

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Popular Name: [1-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-pyrrolidin [1-[(3-cyclopropyl-1,2,4-oxadiaz…

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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)	0.66	3.53	-27.44	0	9	0	109	401.448	4	↓ MOL2 SDF SMILES Flexibase

49402512

Analogs

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Popular Name: [1-[(4-fluorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-(1-piperidyl)methanone [1-[(4-fluorophenyl)methyl]-4,4-…

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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)	2.88	7.25	-23.43	0	6	0	70	401.463	3	↓ MOL2 SDF SMILES Flexibase

49402515

Analogs

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Popular Name: [1-[(3,5-difluorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-(1-piperidyl)methanone [1-[(3,5-difluorophenyl)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)	2.97	7.31	-22.83	0	6	0	70	419.453	3	↓ MOL2 SDF SMILES Flexibase

49402518

Analogs

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Popular Name: [1-[(2-chlorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-(1-piperidyl)methanone [1-[(2-chlorophenyl)methyl]-4,4-…

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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	7.31	-21.92	0	6	0	70	417.918	3	↓ MOL2 SDF SMILES Flexibase

49402521

Analogs

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Popular Name: [1-[(3-chlorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-(1-piperidyl)methanone [1-[(3-chlorophenyl)methyl]-4,4-…

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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)	3.37	7.68	-22.4	0	6	0	70	417.918	3	↓ MOL2 SDF SMILES Flexibase

49402524

Analogs

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Popular Name: [1-[(4-chlorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-(1-piperidyl)methanone [1-[(4-chlorophenyl)methyl]-4,4-…

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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)	3.40	7.69	-22.65	0	6	0	70	417.918	3	↓ MOL2 SDF SMILES Flexibase

49402527

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)	2.05	5.92	-21.75	0	9	0	109	431.47	5	↓ MOL2 SDF SMILES Flexibase

49402530

Analogs

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Popular Name: [1-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-(1-piperid [1-[(3-cyclopropyl-1,2,4-oxadiaz…

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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)	1.16	4.35	-23.76	0	9	0	109	415.475	4	↓ MOL2 SDF SMILES Flexibase

49402533

Analogs

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Popular Name: (1-ethyl-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl)-(4-methyl-1-piperidyl)methanone (1-ethyl-4,4-dioxo-benzo[e][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)	1.94	4.78	-20.65	0	6	0	70	335.429	2	↓ MOL2 SDF SMILES Flexibase

49402536

Analogs

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Popular Name: (1-benzyl-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl)-(4-methyl-1-piperidyl)methanone (1-benzyl-4,4-dioxo-benzo[e][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)	2.96	8.02	-22.89	0	6	0	70	397.5	3	↓ MOL2 SDF SMILES Flexibase

49402540

Analogs

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Popular Name: (4-methyl-1-piperidyl)-[1-(m-tolylmethyl)-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]methanone (4-methyl-1-piperidyl)-[1-(m-tol…

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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)	3.38	8.71	-23	0	6	0	70	411.527	3	↓ MOL2 SDF SMILES Flexibase

49402543

Analogs

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Popular Name: 3-[[3-(4-methylpiperidine-1-carbonyl)-4,4-dioxo-benzo[e][1,3,4]thiadiazin-1-yl]methyl]benzonitrile 3-[[3-(4-methylpiperidine-1-carb…

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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)	2.69	8.4	-27.34	0	7	0	94	422.51	3	↓ MOL2 SDF SMILES Flexibase

49402546

Analogs

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Popular Name: [1-[(2-fluorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-(4-methyl-1-piperidyl)methanon [1-[(2-fluorophenyl)methyl]-4,4-…

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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)	3.07	7.89	-21.88	0	6	0	70	415.49	3	↓ MOL2 SDF SMILES Flexibase

49402549

Analogs

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Popular Name: [1-[(2-chlorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-(4-methyl-1-piperidyl)methanon [1-[(2-chlorophenyl)methyl]-4,4-…

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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)	3.59	8.07	-21.19	0	6	0	70	431.945	3	↓ MOL2 SDF SMILES Flexibase

49402553

Analogs

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Popular Name: [1-[(3-chlorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-(4-methyl-1-piperidyl)methanon [1-[(3-chlorophenyl)methyl]-4,4-…

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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)	3.61	8.53	-23.61	0	6	0	70	431.945	3	↓ MOL2 SDF SMILES Flexibase

49402556

Analogs

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Popular Name: [1-[(4-chlorophenyl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-(4-methyl-1-piperidyl)methanon [1-[(4-chlorophenyl)methyl]-4,4-…

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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)	3.64	8.54	-24.62	0	6	0	70	431.945	3	↓ MOL2 SDF SMILES Flexibase

49402559

Analogs

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Popular Name: [1-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-4,4-dioxo-benzo[e][1,3,4]thiadiazin-3-yl]-(4-methyl- [1-[(3-cyclopropyl-1,2,4-oxadiaz…

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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)	1.40	4.99	-21.15	0	9	0	109	429.502	4	↓ MOL2 SDF SMILES Flexibase

49402562

Analogs

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Popular Name: azepan-1-yl-(4,4-dioxo-1-phenethyl-benzo[e][1,3,4]thiadiazin-3-yl)methanone azepan-1-yl-(4,4-dioxo-1-pheneth…

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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)	3.63	9.25	-21.51	0	6	0	70	411.527	4	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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Structural Results Found: (before additional filtering)

SQL Query Was

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