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ZINC Item

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62036070

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(2R,5S)-5-[[3-methoxypropyl(methyl)amino]methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2R,5S)-5-[[3-methoxypropyl(…

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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)	1.11	5.97	-90.44	3	4	2	40	258.406	9	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	1.11	3.55	-33.01	2	4	1	38	257.398	9	↓ MOL2 SDF SMILES Flexibase

62036071

Analogs

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Popular Name: N-[[(2R,5R)-5-[[3-methoxypropyl(methyl)amino]methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2R,5R)-5-[[3-methoxypropyl(…

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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)	1.11	6.05	-90.81	3	4	2	40	258.406	9	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	1.11	3.65	-32.86	2	4	1	38	257.398	9	↓ MOL2 SDF SMILES Flexibase

52372793

Analogs

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Popular Name: N-[[(2R,5S)-5-[[butyl-[(1S)-1-methylpropyl]amino]methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2R,5S)-5-[[butyl-[(1S)-1-me…

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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)	3.50	9.87	-87.03	3	3	2	30	284.488	10	↓ MOL2 SDF SMILES Flexibase

52372794

Analogs

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Popular Name: N-[[(2R,5R)-5-[[butyl-[(1S)-1-methylpropyl]amino]methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2R,5R)-5-[[butyl-[(1S)-1-me…

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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)	3.50	9.52	-86.43	3	3	2	30	284.488	10	↓ MOL2 SDF SMILES Flexibase

52376689

Analogs

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Popular Name: N-[[(2R,5S)-5-[(diallylamino)methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2R,5S)-5-[(diallylamino)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)	2.14	7.97	-85.85	3	3	2	30	252.402	9	↓ MOL2 SDF SMILES Flexibase

52376691

Analogs

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Popular Name: N-[[(2R,5R)-5-[(diallylamino)methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2R,5R)-5-[(diallylamino)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)	2.14	7.79	-87.17	3	3	2	30	252.402	9	↓ MOL2 SDF SMILES Flexibase

52376693

Analogs

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Popular Name: N-[[(2S,5S)-5-[(diallylamino)methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2S,5S)-5-[(diallylamino)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)	2.14	7.95	-85.96	3	3	2	30	252.402	9	↓ MOL2 SDF SMILES Flexibase

52376695

Analogs

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Popular Name: N-[[(2S,5R)-5-[(diallylamino)methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2S,5R)-5-[(diallylamino)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)	2.14	7.66	-86.82	3	3	2	30	252.402	9	↓ MOL2 SDF SMILES Flexibase

52378374

Analogs

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Popular Name: N-[[(2R,5S)-5-(diethylaminomethyl)tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2R,5S)-5-(diethylaminomethy…

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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)	1.61	6.89	-85.45	3	3	2	30	228.38	7	↓ MOL2 SDF SMILES Flexibase

52378376

Analogs

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Popular Name: N-[[(2R,5R)-5-(diethylaminomethyl)tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2R,5R)-5-(diethylaminomethy…

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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)	1.61	6.65	-86.22	3	3	2	30	228.38	7	↓ MOL2 SDF SMILES Flexibase

52378378

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(2S,5S)-5-(diethylaminomethyl)tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2S,5S)-5-(diethylaminomethy…

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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)	1.61	6.87	-85.71	3	3	2	30	228.38	7	↓ MOL2 SDF SMILES Flexibase

52378379

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(2S,5R)-5-(diethylaminomethyl)tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2S,5R)-5-(diethylaminomethy…

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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)	1.61	6.52	-86.08	3	3	2	30	228.38	7	↓ MOL2 SDF SMILES Flexibase

52416862

Analogs

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Popular Name: N-[[(2R,5S)-5-[(dipropylamino)methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2R,5S)-5-[(dipropylamino)me…

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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	8.33	-87.77	3	3	2	30	256.434	9	↓ MOL2 SDF SMILES Flexibase

52416863

Analogs

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Popular Name: N-[[(2R,5R)-5-[(dipropylamino)methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2R,5R)-5-[(dipropylamino)me…

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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	8.13	-88.64	3	3	2	30	256.434	9	↓ MOL2 SDF SMILES Flexibase

52416864

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(2S,5S)-5-[(dipropylamino)methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2S,5S)-5-[(dipropylamino)me…

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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	8.38	-87.84	3	3	2	30	256.434	9	↓ MOL2 SDF SMILES Flexibase

52416865

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(2S,5R)-5-[(dipropylamino)methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2S,5R)-5-[(dipropylamino)me…

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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	8	-88.37	3	3	2	30	256.434	9	↓ MOL2 SDF SMILES Flexibase

52418055

Analogs

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Popular Name: N-[[(2R,5S)-5-[[butyl(methyl)amino]methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2R,5S)-5-[[butyl(methyl)ami…

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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	7.68	-88.27	3	3	2	30	242.407	8	↓ MOL2 SDF SMILES Flexibase

52418056

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(2R,5R)-5-[[butyl(methyl)amino]methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2R,5R)-5-[[butyl(methyl)ami…

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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	7.75	-88.83	3	3	2	30	242.407	8	↓ MOL2 SDF SMILES Flexibase

52418840

Analogs

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Popular Name: N-[[(2R,5S)-5-[[butyl(ethyl)amino]methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2R,5S)-5-[[butyl(ethyl)amin…

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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)	2.67	8.35	-87.25	3	3	2	30	256.434	9	↓ MOL2 SDF SMILES Flexibase

52418841

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(2R,5R)-5-[[butyl(ethyl)amino]methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2R,5R)-5-[[butyl(ethyl)amin…

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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)	2.67	8.55	-89.28	3	3	2	30	256.434	9	↓ MOL2 SDF SMILES Flexibase

52419681

Analogs

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Popular Name: N-[[(2R,5S)-5-[[isopropyl(methyl)amino]methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2R,5S)-5-[[isopropyl(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)	1.53	7.02	-86.64	3	3	2	30	228.38	6	↓ MOL2 SDF SMILES Flexibase

52419682

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(2R,5R)-5-[[isopropyl(methyl)amino]methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2R,5R)-5-[[isopropyl(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)	1.53	7.08	-86.94	3	3	2	30	228.38	6	↓ MOL2 SDF SMILES Flexibase

52422848

Analogs

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Popular Name: N-[[(2R,5S)-5-(dimethylaminomethyl)tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2R,5S)-5-(dimethylaminometh…

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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)	0.86	5.51	-86.4	3	3	2	30	200.326	5	↓ MOL2 SDF SMILES Flexibase

52422850

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(2R,5R)-5-(dimethylaminomethyl)tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2R,5R)-5-(dimethylaminometh…

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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)	0.86	5.56	-86.83	3	3	2	30	200.326	5	↓ MOL2 SDF SMILES Flexibase

52422852

Analogs

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Popular Name: N-[[(2S,5S)-5-(dimethylaminomethyl)tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2S,5S)-5-(dimethylaminometh…

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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)	0.86	5.49	-86.49	3	3	2	30	200.326	5	↓ MOL2 SDF SMILES Flexibase

52422853

Analogs

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Popular Name: N-[[(2S,5R)-5-(dimethylaminomethyl)tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2S,5R)-5-(dimethylaminometh…

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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)	0.86	5.44	-86.66	3	3	2	30	200.326	5	↓ MOL2 SDF SMILES Flexibase

52423550

Analogs

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Popular Name: N-[[(2R,5S)-5-[[ethyl(2-methylallyl)amino]methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2R,5S)-5-[[ethyl(2-methylal…

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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	7.98	-86.37	3	3	2	30	254.418	8	↓ MOL2 SDF SMILES Flexibase

52423552

Analogs

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Popular Name: N-[[(2R,5R)-5-[[ethyl(2-methylallyl)amino]methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2R,5R)-5-[[ethyl(2-methylal…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.42	8.32	-87.08	3	3	2	30	254.418	8	↓ MOL2 SDF SMILES Flexibase

52443642

Analogs

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Popular Name: N-[[(2R,5S)-5-[(dibutylamino)methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2R,5S)-5-[(dibutylamino)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)	3.73	9.88	-89.74	3	3	2	30	284.488	11	↓ MOL2 SDF SMILES Flexibase

52443643

Analogs

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Popular Name: N-[[(2R,5R)-5-[(dibutylamino)methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2R,5R)-5-[(dibutylamino)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)	3.73	9.68	-90.8	3	3	2	30	284.488	11	↓ MOL2 SDF SMILES Flexibase

52443644

Analogs

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Popular Name: N-[[(2S,5S)-5-[(dibutylamino)methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2S,5S)-5-[(dibutylamino)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)	3.73	9.92	-89.78	3	3	2	30	284.488	11	↓ MOL2 SDF SMILES Flexibase

52443645

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(2S,5R)-5-[(dibutylamino)methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2S,5R)-5-[(dibutylamino)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)	3.73	9.55	-90.53	3	3	2	30	284.488	11	↓ MOL2 SDF SMILES Flexibase

52444278

Analogs

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Popular Name: N-[[(2R,5S)-5-[[methyl-[(1R)-1-methylpropyl]amino]methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamin N-[[(2R,5S)-5-[[methyl-[(1R)-1-m…

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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)	2.06	7.26	-85.65	3	3	2	30	242.407	7	↓ MOL2 SDF SMILES Flexibase

52444279

Analogs

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Popular Name: N-[[(2R,5S)-5-[[methyl-[(1S)-1-methylpropyl]amino]methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamin N-[[(2R,5S)-5-[[methyl-[(1S)-1-m…

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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)	2.06	7.23	-85.47	3	3	2	30	242.407	7	↓ MOL2 SDF SMILES Flexibase

52444585

Analogs

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Popular Name: N-[[(2R,5S)-5-[[methyl(propyl)amino]methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2R,5S)-5-[[methyl(propyl)am…

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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)	1.73	6.89	-87.23	3	3	2	30	228.38	7	↓ MOL2 SDF SMILES Flexibase

52444586

Analogs

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Popular Name: N-[[(2R,5R)-5-[[methyl(propyl)amino]methyl]tetrahydrofuran-2-yl]methyl]cyclopropanamine N-[[(2R,5R)-5-[[methyl(propyl)am…

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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)	1.73	6.98	-87.59	3	3	2	30	228.38	7	↓ MOL2 SDF SMILES Flexibase

52445430

Analogs

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Popular Name: N-[[(2S,5R)-5-(aminomethyl)tetrahydrofuran-2-yl]methyl]-N-methyl-cyclopropanamine N-[[(2S,5R)-5-(aminomethyl)tetra…

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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)	-0.13	3.43	-90.43	4	3	2	41	186.299	4	↓ MOL2 SDF SMILES Flexibase

52445431

Analogs

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Popular Name: N-[[(2R,5R)-5-(aminomethyl)tetrahydrofuran-2-yl]methyl]-N-methyl-cyclopropanamine N-[[(2R,5R)-5-(aminomethyl)tetra…

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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)	-0.13	3.83	-92.28	4	3	2	41	186.299	4	↓ MOL2 SDF SMILES Flexibase

52445529

Analogs

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Popular Name: N-methyl-N-[[(2R,5S)-5-(methylaminomethyl)tetrahydrofuran-2-yl]methyl]cyclopropanamine N-methyl-N-[[(2R,5S)-5-(methylam…

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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)	0.86	5.3	-86.08	3	3	2	30	200.326	5	↓ MOL2 SDF SMILES Flexibase

52445531

Analogs

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Popular Name: N-methyl-N-[[(2R,5R)-5-(methylaminomethyl)tetrahydrofuran-2-yl]methyl]cyclopropanamine N-methyl-N-[[(2R,5R)-5-(methylam…

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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)	0.86	5.3	-87.32	3	3	2	30	200.326	5	↓ MOL2 SDF SMILES Flexibase

52445533

Analogs

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Popular Name: N-methyl-N-[[(2S,5S)-5-(methylaminomethyl)tetrahydrofuran-2-yl]methyl]cyclopropanamine N-methyl-N-[[(2S,5S)-5-(methylam…

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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)	0.86	5.29	-86.14	3	3	2	30	200.326	5	↓ MOL2 SDF SMILES Flexibase

52445536

Analogs

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Popular Name: N-methyl-N-[[(2S,5R)-5-(methylaminomethyl)tetrahydrofuran-2-yl]methyl]cyclopropanamine N-methyl-N-[[(2S,5R)-5-(methylam…

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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)	0.86	5.24	-86.37	3	3	2	30	200.326	5	↓ MOL2 SDF SMILES Flexibase

52445539

Analogs

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Popular Name: N-[[(2R,5S)-5-(ethylaminomethyl)tetrahydrofuran-2-yl]methyl]-N-methyl-cyclopropanamine N-[[(2R,5S)-5-(ethylaminomethyl)…

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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)	0.88	6.17	-85.91	3	3	2	30	214.353	6	↓ MOL2 SDF SMILES Flexibase

52445542

Analogs

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Popular Name: N-[[(2R,5R)-5-(ethylaminomethyl)tetrahydrofuran-2-yl]methyl]-N-methyl-cyclopropanamine N-[[(2R,5R)-5-(ethylaminomethyl)…

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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)	0.88	6.23	-86.26	3	3	2	30	214.353	6	↓ MOL2 SDF SMILES Flexibase

52445544

Analogs

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Popular Name: N-[[(2S,5S)-5-(ethylaminomethyl)tetrahydrofuran-2-yl]methyl]-N-methyl-cyclopropanamine N-[[(2S,5S)-5-(ethylaminomethyl)…

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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)	0.88	6.14	-85.89	3	3	2	30	214.353	6	↓ MOL2 SDF SMILES Flexibase

52445547

Analogs

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Popular Name: N-[[(2S,5R)-5-(ethylaminomethyl)tetrahydrofuran-2-yl]methyl]-N-methyl-cyclopropanamine N-[[(2S,5R)-5-(ethylaminomethyl)…

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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)	0.88	6.09	-86.03	3	3	2	30	214.353	6	↓ MOL2 SDF SMILES Flexibase

52445550

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-methyl-N-[[(2R,5S)-5-(propylaminomethyl)tetrahydrofuran-2-yl]methyl]cyclopropanamine N-methyl-N-[[(2R,5S)-5-(propylam…

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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)	1.38	6.91	-87.41	3	3	2	30	228.38	7	↓ MOL2 SDF SMILES Flexibase

52445552

Analogs

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Popular Name: N-methyl-N-[[(2R,5R)-5-(propylaminomethyl)tetrahydrofuran-2-yl]methyl]cyclopropanamine N-methyl-N-[[(2R,5R)-5-(propylam…

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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)	1.38	6.91	-88.62	3	3	2	30	228.38	7	↓ MOL2 SDF SMILES Flexibase

52445555

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-methyl-N-[[(2S,5S)-5-(propylaminomethyl)tetrahydrofuran-2-yl]methyl]cyclopropanamine N-methyl-N-[[(2S,5S)-5-(propylam…

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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)	1.38	6.89	-87.5	3	3	2	30	228.38	7	↓ MOL2 SDF SMILES Flexibase

52445557

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-methyl-N-[[(2S,5R)-5-(propylaminomethyl)tetrahydrofuran-2-yl]methyl]cyclopropanamine N-methyl-N-[[(2S,5R)-5-(propylam…

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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)	1.38	6.84	-87.59	3	3	2	30	228.38	7	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

SQL Query Was

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