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ZINC Item

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70330304

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-fluoro-4-[(2-pyrrolidin-1-ylphenyl)methylamino]phenol 2-fluoro-4-[(2-pyrrolidin-1-ylph…

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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)	3.52	6.78	-5.06	2	3	0	35	286.35	4	↓ MOL2 SDF SMILES Flexibase

37184681

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-chloro-2-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 5-chloro-2-methyl-N-[(2-pyrrolid…

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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)	4.71	10.87	-2.57	1	2	0	15	300.833	4	↓ MOL2 SDF SMILES Flexibase

37185135

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-ethynyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 3-ethynyl-N-[(2-pyrrolidin-1-ylp…

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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)	3.39	10.78	-4.25	1	2	0	15	276.383	4	↓ MOL2 SDF SMILES Flexibase

37185328

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 3-methyl-N-[(2-pyrrolidin-1-ylph…

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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)	4.08	10.24	-2.6	1	2	0	15	266.388	4	↓ MOL2 SDF SMILES Flexibase

37186047

Analogs

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Popular Name: N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline N-[(2-pyrrolidin-1-ylphenyl)meth…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.65	9.58	-2.46	1	2	0	15	252.361	4	↓ MOL2 SDF SMILES Flexibase

37188117

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2,5-dichloro-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 2,5-dichloro-N-[(2-pyrrolidin-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)	4.93	10.67	-2.03	1	2	0	15	321.251	4	↓ MOL2 SDF SMILES Flexibase

37188288

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-methylsulfanyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 3-methylsulfanyl-N-[(2-pyrrolidi…

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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)	4.06	10.6	-3.45	1	2	0	15	298.455	5	↓ MOL2 SDF SMILES Flexibase

37188472

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-chloro-4-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 3-chloro-4-methyl-N-[(2-pyrrolid…

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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)	4.71	10.68	-2.67	1	2	0	15	300.833	4	↓ MOL2 SDF SMILES Flexibase

37188956

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-bromo-4-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 2-bromo-4-methyl-N-[(2-pyrrolidi…

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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)	4.84	10.97	-2.64	1	2	0	15	345.284	4	↓ MOL2 SDF SMILES Flexibase

37189160

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-methoxy-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 2-methoxy-N-[(2-pyrrolidin-1-ylp…

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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	8.99	-3.65	1	3	0	24	282.387	5	↓ MOL2 SDF SMILES Flexibase

37196631

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-chloro-2-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 3-chloro-2-methyl-N-[(2-pyrrolid…

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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)	4.68	10.79	-2.43	1	2	0	15	300.833	4	↓ MOL2 SDF SMILES Flexibase

37196807

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2,4-dichloro-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 2,4-dichloro-N-[(2-pyrrolidin-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)	4.93	10.67	-2.36	1	2	0	15	321.251	4	↓ MOL2 SDF SMILES Flexibase

37196974

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-bromo-2-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 4-bromo-2-methyl-N-[(2-pyrrolidi…

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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)	4.84	10.99	-2.38	1	2	0	15	345.284	4	↓ MOL2 SDF SMILES Flexibase

37197585

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-methylsulfanyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 4-methylsulfanyl-N-[(2-pyrrolidi…

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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)	4.08	10.6	-3.35	1	2	0	15	298.455	5	↓ MOL2 SDF SMILES Flexibase

37198360

Analogs

37781033
37781034
37781035
37781079

Draw Identity 99% 90% 80% 70%

Popular Name: 2,5-difluoro-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 2,5-difluoro-N-[(2-pyrrolidin-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)	3.91	9.73	-2.73	1	2	0	15	288.341	4	↓ MOL2 SDF SMILES Flexibase

37198554

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-bromo-2-fluoro-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 4-bromo-2-fluoro-N-[(2-pyrrolidi…

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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)	4.55	10.29	-2.71	1	2	0	15	349.247	4	↓ MOL2 SDF SMILES Flexibase

37198756

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-bromo-3-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 4-bromo-3-methyl-N-[(2-pyrrolidi…

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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)	4.84	10.77	-2.4	1	2	0	15	345.284	4	↓ MOL2 SDF SMILES Flexibase

37199559

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,5-dichloro-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 3,5-dichloro-N-[(2-pyrrolidin-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)	4.93	10.59	-1.87	1	2	0	15	321.251	4	↓ MOL2 SDF SMILES Flexibase

37200374

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,4-dichloro-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 3,4-dichloro-N-[(2-pyrrolidin-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)	4.93	10.55	-2.84	1	2	0	15	321.251	4	↓ MOL2 SDF SMILES Flexibase

37201650

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,4-difluoro-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 3,4-difluoro-N-[(2-pyrrolidin-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)	3.91	9.69	-4.43	1	2	0	15	288.341	4	↓ MOL2 SDF SMILES Flexibase

37202270

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,4-dimethyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 3,4-dimethyl-N-[(2-pyrrolidin-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)	4.48	10.8	-2.67	1	2	0	15	280.415	4	↓ MOL2 SDF SMILES Flexibase

37202448

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-chloro-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 3-chloro-N-[(2-pyrrolidin-1-ylph…

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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)	4.31	10.09	-2.43	1	2	0	15	286.806	4	↓ MOL2 SDF SMILES Flexibase

37202628

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-fluoro-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 3-fluoro-N-[(2-pyrrolidin-1-ylph…

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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)	3.79	9.64	-3.07	1	2	0	15	270.351	4	↓ MOL2 SDF SMILES Flexibase

37202810

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 4-chloro-N-[(2-pyrrolidin-1-ylph…

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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)	4.33	10.09	-2.35	1	2	0	15	286.806	4	↓ MOL2 SDF SMILES Flexibase

37202990

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2-pyrrolidin-1-ylphenyl)methylamino]benzonitrile 2-[(2-pyrrolidin-1-ylphenyl)meth…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.36	9.98	-5.79	1	3	0	39	277.371	4	↓ MOL2 SDF SMILES Flexibase

37203161

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[(2-pyrrolidin-1-ylphenyl)methylamino]benzonitrile 3-[(2-pyrrolidin-1-ylphenyl)meth…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.38	9.97	-5.02	1	3	0	39	277.371	4	↓ MOL2 SDF SMILES Flexibase

37203371

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-bromo-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 2-bromo-N-[(2-pyrrolidin-1-ylphe…

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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)	4.41	10.29	-2.7	1	2	0	15	331.257	4	↓ MOL2 SDF SMILES Flexibase

37203567

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-bromo-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 4-bromo-N-[(2-pyrrolidin-1-ylphe…

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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)	4.46	10.2	-2.34	1	2	0	15	331.257	4	↓ MOL2 SDF SMILES Flexibase

37203753

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-bromo-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 3-bromo-N-[(2-pyrrolidin-1-ylphe…

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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)	4.44	10.2	-2.35	1	2	0	15	331.257	4	↓ MOL2 SDF SMILES Flexibase

37210548

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-fluoro-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 4-fluoro-N-[(2-pyrrolidin-1-ylph…

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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	9.64	-3.07	1	2	0	15	270.351	4	↓ MOL2 SDF SMILES Flexibase

37210765

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-chloro-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 2-chloro-N-[(2-pyrrolidin-1-ylph…

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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)	4.28	10.16	-2.72	1	2	0	15	286.806	4	↓ MOL2 SDF SMILES Flexibase

37211210

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-fluoro-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 2-fluoro-N-[(2-pyrrolidin-1-ylph…

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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)	3.77	9.66	-3.4	1	2	0	15	270.351	4	↓ MOL2 SDF SMILES Flexibase

37212087

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[(2-pyrrolidin-1-ylphenyl)methylamino]benzonitrile 4-[(2-pyrrolidin-1-ylphenyl)meth…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.41	9.98	-5.47	1	3	0	39	277.371	4	↓ MOL2 SDF SMILES Flexibase

37212257

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2,4-difluoro-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 2,4-difluoro-N-[(2-pyrrolidin-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)	3.91	9.73	-3.27	1	2	0	15	288.341	4	↓ MOL2 SDF SMILES Flexibase

37212446

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,5-dimethyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 3,5-dimethyl-N-[(2-pyrrolidin-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)	4.48	10.9	-2.72	1	2	0	15	280.415	4	↓ MOL2 SDF SMILES Flexibase

37212629

Analogs

37781079

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Popular Name: 5-fluoro-2-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 5-fluoro-2-methyl-N-[(2-pyrrolid…

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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)	4.19	10.44	-3.29	1	2	0	15	284.378	4	↓ MOL2 SDF SMILES Flexibase

37212949

Analogs

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Popular Name: 4-ethyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 4-ethyl-N-[(2-pyrrolidin-1-ylphe…

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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)	4.57	11.01	-2.24	1	2	0	15	280.415	5	↓ MOL2 SDF SMILES Flexibase

37213167

Analogs

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Popular Name: 3-fluoro-4-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 3-fluoro-4-methyl-N-[(2-pyrrolid…

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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)	4.19	10.29	-3.43	1	2	0	15	284.378	4	↓ MOL2 SDF SMILES Flexibase

37213354

Analogs

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Popular Name: 2-ethyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 2-ethyl-N-[(2-pyrrolidin-1-ylphe…

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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)	4.52	11.12	-2.29	1	2	0	15	280.415	5	↓ MOL2 SDF SMILES Flexibase

37213996

Analogs

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Popular Name: 4-fluoro-2-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 4-fluoro-2-methyl-N-[(2-pyrrolid…

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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)	4.19	10.44	-3.14	1	2	0	15	284.378	4	↓ MOL2 SDF SMILES Flexibase

37214182

Analogs

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Popular Name: 3,5-difluoro-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 3,5-difluoro-N-[(2-pyrrolidin-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)	3.91	9.71	-2.53	1	2	0	15	288.341	4	↓ MOL2 SDF SMILES Flexibase

37214374

Analogs

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Popular Name: 3-ethyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 3-ethyl-N-[(2-pyrrolidin-1-ylphe…

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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)	4.54	11.01	-2.36	1	2	0	15	280.415	5	↓ MOL2 SDF SMILES Flexibase

37215428

Analogs

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Popular Name: 3-methoxy-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 3-methoxy-N-[(2-pyrrolidin-1-ylp…

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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	8.88	-3.94	1	3	0	24	282.387	5	↓ MOL2 SDF SMILES Flexibase

37215616

Analogs

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Popular Name: 2,3-dimethyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 2,3-dimethyl-N-[(2-pyrrolidin-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)	4.45	10.92	-2.71	1	2	0	15	280.415	4	↓ MOL2 SDF SMILES Flexibase

37215797

Analogs

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Popular Name: 4-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 4-methyl-N-[(2-pyrrolidin-1-ylph…

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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)	4.10	10.26	-2.43	1	2	0	15	266.388	4	↓ MOL2 SDF SMILES Flexibase

37215986

Analogs

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Popular Name: 2,5-dimethyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 2,5-dimethyl-N-[(2-pyrrolidin-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)	4.48	11.03	-2.63	1	2	0	15	280.415	4	↓ MOL2 SDF SMILES Flexibase

37216165

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-methoxy-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 4-methoxy-N-[(2-pyrrolidin-1-ylp…

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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)	3.71	8.88	-3.76	1	3	0	24	282.387	5	↓ MOL2 SDF SMILES Flexibase

37216347

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 2-methyl-N-[(2-pyrrolidin-1-ylph…

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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)	4.05	10.37	-2.47	1	2	0	15	266.388	4	↓ MOL2 SDF SMILES Flexibase

37217127

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-2-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline 4-chloro-2-methyl-N-[(2-pyrrolid…

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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)	4.71	10.87	-2.41	1	2	0	15	300.833	4	↓ MOL2 SDF SMILES Flexibase

37237873

Analogs

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Popular Name: 3-[(2-pyrrolidin-1-ylphenyl)methylamino]phenol 3-[(2-pyrrolidin-1-ylphenyl)meth…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.15	6.72	-4.14	2	3	0	35	268.36	4	↓ MOL2 SDF SMILES Flexibase

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Structural Results Found: (before additional filtering)

SQL Query Was

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