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ZINC Item

Suppliers, Protomers, & Similar Substances

23005186

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[3-(4-dimethylaminophenyl)propyl]-N'-(4-nitrophenyl)oxamide N-[3-(4-dimethylaminophenyl)prop…

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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	7.43	-12.53	2	8	0	107	370.409	8	↓ MOL2 SDF SMILES Flexibase

23005192

Analogs

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Popular Name: N'-(2,5-dimethoxyphenyl)-N-[3-(4-dimethylaminophenyl)propyl]oxamide N'-(2,5-dimethoxyphenyl)-N-[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)	2.69	5.53	-11.82	2	7	0	80	385.464	9	↓ MOL2 SDF SMILES Flexibase

23005199

Analogs

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Popular Name: N-[3-(4-dimethylaminophenyl)propyl]-N'-(4-methoxyphenyl)oxamide N-[3-(4-dimethylaminophenyl)prop…

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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	6.09	-10.41	2	6	0	71	355.438	8	↓ MOL2 SDF SMILES Flexibase

23005202

Analogs

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Popular Name: N'-(4-chlorophenyl)-N-[3-(4-dimethylaminophenyl)propyl]oxamide N'-(4-chlorophenyl)-N-[3-(4-dime…

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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	7.29	-8.74	2	5	0	61	359.857	7	↓ MOL2 SDF SMILES Flexibase

23005205

Analogs

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Popular Name: N'-[3-(4-dimethylaminophenyl)propyl]-N-(p-tolyl)oxamide N'-[3-(4-dimethylaminophenyl)pro…

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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	7.53	-9.37	2	5	0	61	339.439	7	↓ MOL2 SDF SMILES Flexibase

23005209

Analogs

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Popular Name: N'-(3-chlorophenyl)-N-[3-(4-dimethylaminophenyl)propyl]oxamide N'-(3-chlorophenyl)-N-[3-(4-dime…

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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)	3.30	7.29	-9.99	2	5	0	61	359.857	7	↓ MOL2 SDF SMILES Flexibase

23005212

Analogs

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Popular Name: N'-[3-(4-dimethylaminophenyl)propyl]-N-(m-tolyl)oxamide N'-[3-(4-dimethylaminophenyl)pro…

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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	7.56	-9.67	2	5	0	61	339.439	7	↓ MOL2 SDF SMILES Flexibase

23005215

Analogs

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Popular Name: N'-[3-(4-dimethylaminophenyl)propyl]-N-(3,5-dimethylphenyl)oxamide N'-[3-(4-dimethylaminophenyl)pro…

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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)	3.47	8.22	-9.58	2	5	0	61	353.466	7	↓ MOL2 SDF SMILES Flexibase

23005221

Analogs

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Popular Name: N'-[3-(4-dimethylaminophenyl)propyl]-N-(2-methoxy-5-methyl-phenyl)oxamide N'-[3-(4-dimethylaminophenyl)pro…

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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	7	-10.16	2	6	0	71	369.465	8	↓ MOL2 SDF SMILES Flexibase

23005224

Analogs

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Popular Name: N'-[3-(4-dimethylaminophenyl)propyl]-N-(4-ethoxyphenyl)oxamide N'-[3-(4-dimethylaminophenyl)pro…

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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	7.12	-10.57	2	6	0	71	369.465	9	↓ MOL2 SDF SMILES Flexibase

23005234

Analogs

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Popular Name: N'-(2,4-dimethoxyphenyl)-N-[3-(4-dimethylaminophenyl)propyl]oxamide N'-(2,4-dimethoxyphenyl)-N-[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)	2.69	5.52	-10.22	2	7	0	80	385.464	9	↓ MOL2 SDF SMILES Flexibase

23005237

Analogs

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Popular Name: N-[3-(4-dimethylaminophenyl)propyl]-N'-(2-methylsulfanylphenyl)oxamide N-[3-(4-dimethylaminophenyl)prop…

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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)	3.03	7.95	-9.53	2	5	0	61	371.506	8	↓ MOL2 SDF SMILES Flexibase

23005243

Analogs

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Popular Name: N-[3-(4-dimethylaminophenyl)propyl]-N'-(2-fluorophenyl)oxamide N-[3-(4-dimethylaminophenyl)prop…

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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)	2.76	6.92	-8.75	2	5	0	61	343.402	7	↓ MOL2 SDF SMILES Flexibase

23005246

Analogs

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Popular Name: N-[3-(4-dimethylaminophenyl)propyl]-N'-(4-fluoro-3-nitro-phenyl)oxamide N-[3-(4-dimethylaminophenyl)prop…

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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	7.47	-16.99	2	8	0	107	388.399	8	↓ MOL2 SDF SMILES Flexibase

23005249

Analogs

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Popular Name: N'-(2,4-difluorophenyl)-N-[3-(4-dimethylaminophenyl)propyl]oxamide N'-(2,4-difluorophenyl)-N-[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)	2.90	6.98	-7.55	2	5	0	61	361.392	7	↓ MOL2 SDF SMILES Flexibase

23005252

Analogs

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Popular Name: N'-(2,5-difluorophenyl)-N-[3-(4-dimethylaminophenyl)propyl]oxamide N'-(2,5-difluorophenyl)-N-[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)	2.90	6.96	-9.04	2	5	0	61	361.392	7	↓ MOL2 SDF SMILES Flexibase

23005255

Analogs

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Popular Name: N-[3-(4-dimethylaminophenyl)propyl]-N'-(3-fluorophenyl)oxamide N-[3-(4-dimethylaminophenyl)prop…

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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)	2.79	6.84	-10.96	2	5	0	61	343.402	7	↓ MOL2 SDF SMILES Flexibase

23005257

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-(3,4-difluorophenyl)-N-[3-(4-dimethylaminophenyl)propyl]oxamide N'-(3,4-difluorophenyl)-N-[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)	2.90	6.9	-11.64	2	5	0	61	361.392	7	↓ MOL2 SDF SMILES Flexibase

23005260

Analogs

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Popular Name: N'-[3-(4-dimethylaminophenyl)propyl]-N-(3-fluoro-4-methyl-phenyl)oxamide N'-[3-(4-dimethylaminophenyl)pro…

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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)	3.19	7.59	-11.24	2	5	0	61	357.429	7	↓ MOL2 SDF SMILES Flexibase

23005262

Analogs

740071

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Popular Name: N-[3-(4-dimethylaminophenyl)propyl]-N'-[4-(trifluoromethyl)phenyl]oxamide N-[3-(4-dimethylaminophenyl)prop…

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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	7.78	-9.42	2	5	0	61	393.409	8	↓ MOL2 SDF SMILES Flexibase

23005265

Analogs

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Popular Name: N-[3-(4-dimethylaminophenyl)propyl]-N'-[4-(trifluoromethoxy)phenyl]oxamide N-[3-(4-dimethylaminophenyl)prop…

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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)	3.62	6.56	-8.63	2	6	0	71	409.408	9	↓ MOL2 SDF SMILES Flexibase

23005268

Analogs

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Popular Name: N'-(3-chloro-4-methoxy-phenyl)-N-[3-(4-dimethylaminophenyl)propyl]oxamide N'-(3-chloro-4-methoxy-phenyl)-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)	3.31	6.64	-11.96	2	6	0	71	389.883	8	↓ MOL2 SDF SMILES Flexibase

23005271

Analogs

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Popular Name: N-[3-(4-dimethylaminophenyl)propyl]-N'-(3-methoxyphenyl)oxamide N-[3-(4-dimethylaminophenyl)prop…

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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)	2.68	6.09	-11.73	2	6	0	71	355.438	8	↓ MOL2 SDF SMILES Flexibase

23005274

Analogs

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Popular Name: N'-[3-(4-dimethylaminophenyl)propyl]-N-(2-ethylphenyl)oxamide N'-[3-(4-dimethylaminophenyl)pro…

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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)	3.51	8.55	-8.91	2	5	0	61	353.466	8	↓ MOL2 SDF SMILES Flexibase

23005277

Analogs

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Popular Name: N'-[3-(4-dimethylaminophenyl)propyl]-N-(4-ethylphenyl)oxamide N'-[3-(4-dimethylaminophenyl)pro…

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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)	3.56	8.3	-9.21	2	5	0	61	353.466	8	↓ MOL2 SDF SMILES Flexibase

23005280

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)	2.82	7.43	-11.72	2	7	0	88	383.448	9	↓ MOL2 SDF SMILES Flexibase

23005283

Analogs

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Popular Name: N-[3-(4-dimethylaminophenyl)propyl]-N'-phenyl-oxamide N-[3-(4-dimethylaminophenyl)prop…

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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)	2.65	6.85	-8.28	2	5	0	61	325.412	7	↓ MOL2 SDF SMILES Flexibase

23005285

Analogs

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Popular Name: N'-(3,4-dimethoxyphenyl)-N-[3-(4-dimethylaminophenyl)propyl]oxamide N'-(3,4-dimethoxyphenyl)-N-[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)	2.29	6.01	-12.06	2	7	0	80	385.464	9	↓ MOL2 SDF SMILES Flexibase

23005307

Analogs

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Popular Name: N'-[3-(4-dimethylaminophenyl)propyl]-N-(2,3-dimethylphenyl)oxamide N'-[3-(4-dimethylaminophenyl)pro…

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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)	3.45	8.42	-9.46	2	5	0	61	353.466	7	↓ MOL2 SDF SMILES Flexibase

23005310

Analogs

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Popular Name: N-(3-chloro-2-methyl-phenyl)-N'-[3-(4-dimethylaminophenyl)propyl]oxamide N-(3-chloro-2-methyl-phenyl)-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)	3.68	8.2	-8.46	2	5	0	61	373.884	7	↓ MOL2 SDF SMILES Flexibase

23005313

Analogs

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Popular Name: N-[3-(4-dimethylaminophenyl)propyl]-N'-(2-nitrophenyl)oxamide N-[3-(4-dimethylaminophenyl)prop…

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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)	2.56	7.81	-12.13	2	8	0	107	370.409	8	↓ MOL2 SDF SMILES Flexibase

23005316

Analogs

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Popular Name: N'-[3-(4-dimethylaminophenyl)propyl]-N-(4-methyl-2-nitro-phenyl)oxamide N'-[3-(4-dimethylaminophenyl)pro…

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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	8.51	-11.24	2	8	0	107	384.436	8	↓ MOL2 SDF SMILES Flexibase

23005319

Analogs

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Popular Name: N'-[3-(4-dimethylaminophenyl)propyl]-N-(2-ethoxyphenyl)oxamide N'-[3-(4-dimethylaminophenyl)pro…

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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)	3.03	7.27	-9.56	2	6	0	71	369.465	9	↓ MOL2 SDF SMILES Flexibase

23005322

Analogs

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Popular Name: N'-(5-chloro-2-methoxy-phenyl)-N-[3-(4-dimethylaminophenyl)propyl]oxamide N'-(5-chloro-2-methoxy-phenyl)-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)	3.31	6.73	-9.84	2	6	0	71	389.883	8	↓ MOL2 SDF SMILES Flexibase

23005325

Analogs

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Popular Name: N'-[3-(4-dimethylaminophenyl)propyl]-N-(3,4-dimethylphenyl)oxamide N'-[3-(4-dimethylaminophenyl)pro…

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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)	3.47	8.21	-9.62	2	5	0	61	353.466	7	↓ MOL2 SDF SMILES Flexibase

23005328

Analogs

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Popular Name: N-(3-chloro-4-methyl-phenyl)-N'-[3-(4-dimethylaminophenyl)propyl]oxamide N-(3-chloro-4-methyl-phenyl)-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)	3.70	8	-10.33	2	5	0	61	373.884	7	↓ MOL2 SDF SMILES Flexibase

23005331

Analogs

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Popular Name: N'-[3-(4-dimethylaminophenyl)propyl]-N-(2,5-dimethylphenyl)oxamide N'-[3-(4-dimethylaminophenyl)pro…

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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)	3.47	8.41	-9.52	2	5	0	61	353.466	7	↓ MOL2 SDF SMILES Flexibase

23005334

Analogs

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Popular Name: N-[3-(4-dimethylaminophenyl)propyl]-N'-(3-nitrophenyl)oxamide N-[3-(4-dimethylaminophenyl)prop…

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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)	2.58	7.43	-15.91	2	8	0	107	370.409	8	↓ MOL2 SDF SMILES Flexibase

23005336

Analogs

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Popular Name: N'-[3-(4-dimethylaminophenyl)propyl]-N-(2-methyl-4-nitro-phenyl)oxamide N'-[3-(4-dimethylaminophenyl)pro…

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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	8.39	-11.93	2	8	0	107	384.436	8	↓ MOL2 SDF SMILES Flexibase

23005339

Analogs

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Popular Name: N'-[3-(4-dimethylaminophenyl)propyl]-N-(2-methyl-5-nitro-phenyl)oxamide N'-[3-(4-dimethylaminophenyl)pro…

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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	8.35	-15.24	2	8	0	107	384.436	8	↓ MOL2 SDF SMILES Flexibase

23005342

Analogs

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Popular Name: N'-[3-(4-dimethylaminophenyl)propyl]-N-(4-isopropylphenyl)oxamide N'-[3-(4-dimethylaminophenyl)pro…

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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)	4.16	8.83	-9.04	2	5	0	61	367.493	8	↓ MOL2 SDF SMILES Flexibase

23005345

Analogs

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Popular Name: N-(3-acetamidophenyl)-N'-[3-(4-dimethylaminophenyl)propyl]oxamide N-(3-acetamidophenyl)-N'-[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)	1.84	5.78	-15.5	3	7	0	91	382.464	8	↓ MOL2 SDF SMILES Flexibase

23005348

Analogs

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Popular Name: N-(4-acetamidophenyl)-N'-[3-(4-dimethylaminophenyl)propyl]oxamide N-(4-acetamidophenyl)-N'-[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)	1.87	5.78	-15.92	3	7	0	91	382.464	8	↓ MOL2 SDF SMILES Flexibase

62566627

Analogs

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Popular Name: N'-(2-chloro-4-methoxy-phenyl)-N-[(1R)-1-methyl-3-phenyl-propyl]oxamide N'-(2-chloro-4-methoxy-phenyl)-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)	3.54	7.34	-6.64	2	5	0	67	360.841	7	↓ MOL2 SDF SMILES Flexibase

62568652

Analogs

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Popular Name: N'-(2-chloro-4-methoxy-phenyl)-N-[(1S)-3-(4-hydroxyphenyl)-1-methyl-propyl]oxamide N'-(2-chloro-4-methoxy-phenyl)-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)	3.06	4.48	-8.66	3	6	0	88	376.84	7	↓ MOL2 SDF SMILES Flexibase

62584959

Analogs

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Popular Name: N'-(2-chloro-4-methoxy-phenyl)-N-methyl-N-(3-phenylpropyl)oxamide N'-(2-chloro-4-methoxy-phenyl)-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)	3.45	8.52	-7.52	1	5	0	59	360.841	7	↓ MOL2 SDF SMILES Flexibase

62586262

Analogs

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Popular Name: N'-(2-chloro-4-methoxy-phenyl)-N-[(1R)-3-(4-methoxyphenyl)-1-methyl-propyl]oxamide N'-(2-chloro-4-methoxy-phenyl)-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)	3.59	6.64	-8.38	2	6	0	77	390.867	8	↓ MOL2 SDF SMILES Flexibase

62601106

Analogs

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Popular Name: N-(2-methoxyethyl)-N'-(4-methoxyphenyl)-N-(3-phenylpropyl)oxamide N-(2-methoxyethyl)-N'-(4-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)	2.83	8.06	-10.28	1	6	0	68	370.449	10	↓ MOL2 SDF SMILES Flexibase

54840432

Analogs

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Popular Name: N'-[2-(3-methoxypropoxy)phenyl]-N-[(1S)-1-methyl-3-phenyl-propyl]oxamide N'-[2-(3-methoxypropoxy)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)	3.14	7.63	-9.51	2	6	0	77	384.476	11	↓ MOL2 SDF SMILES Flexibase

54840433

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N'-[2-(3-methoxypropoxy)phenyl]-N-[(1R)-1-methyl-3-phenyl-propyl]oxamide N'-[2-(3-methoxypropoxy)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)	3.14	7.63	-9.49	2	6	0	77	384.476	11	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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filter.purchasability = annotated
page.format = targets
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Structural Results Found: (before additional filtering)

SQL Query Was

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Embed Link to Results

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