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• Synonyms (0)
• Vendors (0)
• Annotations (1)
• Representations (1)
• Notes (0)
• Targets (0)
• Clustered (0)
• Reactome (0)
• Rings (0)
• Analogs (24)

ZINC14371655

• 14371655

Physical Representations

Activity (Go SEA)

• 14371656
  

  Analogs

  14371657

  

  37803742

  

  37803745

  

  37803746

  

  37803754

  

  Popular Name: (1R,2R)-N,2-dimethyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]cyclopropane-1-carboxamide (1R,2R)-N,2-dimethyl-N-[(4-oxo-3…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 47139324

  Draw Identity 99% 90% 80% 70%

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	1.45	5.73	-17.3	1	5	0	66	277.349	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC14371656
• 14371657
  

  Analogs

  37803742

  

  37803745

  

  37803746

  

  37803759

  

  37803760

  

  Popular Name: (1R,2S)-N,2-dimethyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]cyclopropane-1-carboxamide (1R,2S)-N,2-dimethyl-N-[(4-oxo-3…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 47139324

  Draw Identity 99% 90% 80% 70%

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	1.45	5.77	-16.58	1	5	0	66	277.349	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC14371657
• 37803745
  

  Analogs

  14371655

  

  14371656

  

  14371657

  

  14371654

  

  30031825

  

  Popular Name: (3R)-N-methyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]piperidine-3-carboxamide (3R)-N-methyl-N-[(4-oxo-3H-thien…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Enamine BB Make on Demand

    • BBV-32153187
    • BBV-44495774

  • UORSY BB Make-on-demand

    • BBV-32153187

  Draw Identity 99% 90% 80% 70%

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	0.18	4.2	-54.95	3	6	1	83	307.399	3	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	0.64	1.42	-76.48	2	6	0	86	306.391	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37803745
• 37803746
  

  Analogs

  14371655

  

  14371656

  

  14371657

  

  14371654

  

  30031825

  

  Popular Name: (3S)-N-methyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]piperidine-3-carboxamide (3S)-N-methyl-N-[(4-oxo-3H-thien…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Enamine BB Make on Demand

    • BBV-32153187
    • BBV-44495771

  • UORSY BB Make-on-demand

    • BBV-32153187

  Draw Identity 99% 90% 80% 70%

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	0.18	4.14	-53.71	3	6	1	83	307.399	3	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	0.64	1.36	-72.56	2	6	0	86	306.391	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37803746
• 37803754
  

  Analogs

  14371529

  

  14202428

  

  30031825

  

  14371610

  

  Popular Name: (2S,3R)-2-amino-N,3-dimethyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]pentanamide (2S,3R)-2-amino-N,3-dimethyl-N-[…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 61173218
    • 60940183

  • Enamine BB Make on Demand

    • BBV-32514606

  • UORSY BB Make-on-demand

    • BBV-32153193
    • BBV-32514606

  Draw Identity 99% 90% 80% 70%

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	0.46	3.5	-54.36	4	6	1	94	309.415	5	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	0.92	0.72	-65.69	3	6	0	97	308.407	5	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	0.92	0.41	-60.89	2	6	-1	95	307.399	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37803754
• 37803755
  

  Analogs

  14371529

  

  14202428

  

  30031825

  

  14371610

  

  Popular Name: (2S,3S)-2-amino-N,3-dimethyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]pentanamide (2S,3S)-2-amino-N,3-dimethyl-N-[…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 61173218
    • 61164467
    • 60940183

  • Enamine BB Make on Demand

    • BBV-32514606

  • UORSY BB Make-on-demand

    • BBV-32153193

  And 2 More

  Draw Identity 99% 90% 80% 70%

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	0.46	3.65	-55.43	4	6	1	94	309.415	5	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	0.92	0.87	-67	3	6	0	97	308.407	5	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	0.92	0.54	-61.65	2	6	-1	95	307.399	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37803755
• 37803756
  

  Analogs

  14371529

  

  14202428

  

  30031825

  

  14371610

  

  Popular Name: (2R,3R)-2-amino-N,3-dimethyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]pentanamide (2R,3R)-2-amino-N,3-dimethyl-N-[…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 60940183

  • UORSY BB Make-on-demand

    • BBV-32153193

  Draw Identity 99% 90% 80% 70%

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	0.46	3.67	-56.84	4	6	1	94	309.415	5	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	0.92	0.68	-77.3	3	6	0	97	308.407	5	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	0.92	0.4	-59.95	2	6	-1	95	307.399	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37803756
• 37803757
  

  Analogs

  14371529

  

  14202428

  

  30031825

  

  14371610

  

  Popular Name: (2R,3S)-2-amino-N,3-dimethyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]pentanamide (2R,3S)-2-amino-N,3-dimethyl-N-[…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 60940183

  • UORSY BB Make-on-demand

    • BBV-32153193

  Draw Identity 99% 90% 80% 70%

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	0.46	3.52	-55.23	4	6	1	94	309.415	5	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	0.92	0.74	-74.22	3	6	0	97	308.407	5	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	0.92	0.43	-58.75	2	6	-1	95	307.399	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37803757
• 37803759
  

  Analogs

  30031825

  

  14371529

  

  14371731

  

  Popular Name: (2S)-2-amino-N,4-dimethyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]pentanamide (2S)-2-amino-N,4-dimethyl-N-[(4-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 61164279
    • 60940289

  • Enamine BB Make on Demand

    • BBV-32504054
    • BBV-32153195

  • UORSY BB Make-on-demand

    • BBV-32153195

  And 1 More

  Draw Identity 99% 90% 80% 70%

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	0.49	3.55	-54.59	4	6	1	94	309.415	5	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	0.95	0.51	-56.99	2	6	-1	95	307.399	5	↓ MOL2 SDF SMILES Flexibase
  Mid Mid (pH 6-8)	0.49	3.25	-15.74	3	6	0	92	308.407	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37803759
• 37803760
  

  Analogs

  30031825

  

  14371529

  

  14371731

  

  Popular Name: (2R)-2-amino-N,4-dimethyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]pentanamide (2R)-2-amino-N,4-dimethyl-N-[(4-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 60940289

  • Enamine BB Make on Demand

    • BBV-32153195

  • UORSY BB Make-on-demand

    • BBV-32153195

  Draw Identity 99% 90% 80% 70%

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	0.49	3.53	-55.07	4	6	1	94	309.415	5	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	0.95	0.43	-59.95	2	6	-1	95	307.399	5	↓ MOL2 SDF SMILES Flexibase
  Mid Mid (pH 6-8)	0.49	3.23	-16.8	3	6	0	92	308.407	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37803760
• 37803773
  

  Analogs

  29807241

  

  29807237

  

  14371530

  

  Popular Name: (3S)-3-amino-N-methyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]butanamide (3S)-3-amino-N-methyl-N-[(4-oxo-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 54870288

  • Enamine BB Make on Demand

    • BBV-32153203

  • UORSY BB Make-on-demand

    • BBV-32153203

  Draw Identity 99% 90% 80% 70%

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	0.67	2.53	-50.85	4	6	1	94	281.361	4	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	1.13	-0.25	-67.99	3	6	0	97	280.353	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37803773
• 37803774
  

  Analogs

  29807241

  

  29807237

  

  14371530

  

  Popular Name: (3R)-3-amino-N-methyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]butanamide (3R)-3-amino-N-methyl-N-[(4-oxo-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 54870288

  • Enamine BB Make on Demand

    • BBV-32153203

  • UORSY BB Make-on-demand

    • BBV-32153203

  Draw Identity 99% 90% 80% 70%

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	0.67	2.53	-49.47	4	6	1	94	281.361	4	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	1.13	-0.25	-58.39	3	6	0	97	280.353	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37803774
• 37803780
  

  Analogs

  14371610

  

  Popular Name: (2S)-2-amino-N,2-dimethyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]pentanamide (2S)-2-amino-N,2-dimethyl-N-[(4-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 60938869

  • Enamine BB Make on Demand

    • BBV-32153207

  • UORSY BB Make-on-demand

    • BBV-32153207

  Draw Identity 99% 90% 80% 70%

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	1.26	3.53	-58.48	4	6	1	94	309.415	5	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	1.71	0.75	-68.23	3	6	0	97	308.407	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37803780
• 37803781
  

  Analogs

  14371610

  

  Popular Name: (2R)-2-amino-N,2-dimethyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]pentanamide (2R)-2-amino-N,2-dimethyl-N-[(4-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 60938869

  • Enamine BB Make on Demand

    • BBV-32153207

  • UORSY BB Make-on-demand

    • BBV-32153207

  Draw Identity 99% 90% 80% 70%

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	1.26	3.49	-57	4	6	1	94	309.415	5	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	1.71	0.7	-65.67	3	6	0	97	308.407	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37803781
• 37803782
  

  Analogs

  30031825

  

  29807237

  

  29807241

  

  14371530

  

  Popular Name: (2R)-2-amino-N-methyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]butanediamide (2R)-2-amino-N-methyl-N-[(4-oxo-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Enamine BB Make on Demand

    • BBV-32153208

  • UORSY BB Make-on-demand

    • BBV-32153208

  Draw Identity 99% 90% 80% 70%

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	-0.94	-1.56	-52.25	6	8	1	137	310.359	5	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	-0.48	-4.68	-56.21	4	8	-1	138	308.343	5	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	-0.48	-4.34	-64.66	5	8	0	140	309.351	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37803782
• 37803783
  

  Analogs

  30031825

  

  29807237

  

  29807241

  

  14371530

  

  Popular Name: (2S)-2-amino-N-methyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]butanediamide (2S)-2-amino-N-methyl-N-[(4-oxo-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Enamine BB Make on Demand

    • BBV-32153208

  • UORSY BB Make-on-demand

    • BBV-32153208

  Draw Identity 99% 90% 80% 70%

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	-0.94	-1.58	-52.46	6	8	1	137	310.359	5	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	-0.48	-4.68	-51.19	4	8	-1	138	308.343	5	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	-0.48	-4.36	-62.53	5	8	0	140	309.351	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37803783
• 37803785
  

  Analogs

  14371657

  

  14371656

  

  14371655

  

  14371654

  

  14371610

  

  Popular Name: (2R)-2-amino-2-cyclopropyl-N-methyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]propanamide (2R)-2-amino-2-cyclopropyl-N-met…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 60939000

  • Enamine BB Make on Demand

    • BBV-32153210

  • UORSY BB Make-on-demand

    • BBV-32153210

  Draw Identity 99% 90% 80% 70%

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	0.69	3.06	-51.32	4	6	1	94	307.399	4	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	1.15	0.28	-69.73	3	6	0	97	306.391	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37803785
• 37803786
  

  Analogs

  14371657

  

  14371656

  

  14371655

  

  14371654

  

  14371610

  

  Popular Name: (2S)-2-amino-2-cyclopropyl-N-methyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]propanamide (2S)-2-amino-2-cyclopropyl-N-met…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 60939000

  • Enamine BB Make on Demand

    • BBV-32153210

  • UORSY BB Make-on-demand

    • BBV-32153210

  Draw Identity 99% 90% 80% 70%

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	0.69	3.68	-60.59	4	6	1	94	307.399	4	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	1.15	0.89	-83.38	3	6	0	97	306.391	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37803786
• 37828229
  

  Analogs

  14371654

  

  14371655

  

  14371656

  

  14371657

  

  Popular Name: (1S,2R)-2-[methyl-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]carbamoyl]cyclopropanecarboxylic (1S,2R)-2-[methyl-[(4-oxo-3H-thi…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Enamine BB Make on Demand

    • BBV-32166146

  • UORSY BB Make-on-demand

    • BBV-32166146

  Draw Identity 99% 90% 80% 70%

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	0.32	5.59	-56.84	1	7	-1	106	306.323	4	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	0.78	2.82	-111.24	0	7	-2	109	305.315	4	↓ MOL2 SDF SMILES Flexibase
  Lo Low (pH 4.5-6)	0.32	3.66	-23.57	2	7	0	103	307.331	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37828229
• 37828230
  

  Analogs

  14371654

  

  14371655

  

  14371656

  

  14371657

  

  Popular Name: (1S,2S)-2-[methyl-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]carbamoyl]cyclopropanecarboxylic (1S,2S)-2-[methyl-[(4-oxo-3H-thi…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Enamine BB Make on Demand

    • BBV-32166146

  • UORSY BB Make-on-demand

    • BBV-32166146

  Draw Identity 99% 90% 80% 70%

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	0.32	5.68	-58.49	1	7	-1	106	306.323	4	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	0.78	2.9	-108.19	0	7	-2	109	305.315	4	↓ MOL2 SDF SMILES Flexibase
  Lo Low (pH 4.5-6)	0.32	3.69	-19.71	2	7	0	103	307.331	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37828230
• 37828231
  

  Analogs

  14371654

  

  14371655

  

  14371656

  

  14371657

  

  Popular Name: (1R,2R)-2-[methyl-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]carbamoyl]cyclopropanecarboxylic (1R,2R)-2-[methyl-[(4-oxo-3H-thi…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Enamine BB Make on Demand

    • BBV-32166146

  • UORSY BB Make-on-demand

    • BBV-32166146

  Draw Identity 99% 90% 80% 70%

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	0.32	5.68	-57.05	1	7	-1	106	306.323	4	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	0.78	2.91	-102.73	0	7	-2	109	305.315	4	↓ MOL2 SDF SMILES Flexibase
  Lo Low (pH 4.5-6)	0.32	3.68	-19.09	2	7	0	103	307.331	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37828231
• 37828232
  

  Analogs

  14371654

  

  14371655

  

  14371656

  

  14371657

  

  Popular Name: (1R,2S)-2-[methyl-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]carbamoyl]cyclopropanecarboxylic (1R,2S)-2-[methyl-[(4-oxo-3H-thi…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Enamine BB Make on Demand

    • BBV-32166146

  • UORSY BB Make-on-demand

    • BBV-32166146

  Draw Identity 99% 90% 80% 70%

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	0.32	5.51	-59.29	1	7	-1	106	306.323	4	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	0.78	2.81	-131.22	0	7	-2	109	305.315	4	↓ MOL2 SDF SMILES Flexibase
  Lo Low (pH 4.5-6)	0.32	4.73	-22.48	2	7	0	103	307.331	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37828232
• 37829563
  

  Analogs

  14371529

  

  30031825

  

  14371610

  

  Popular Name: 5-chloro-N-methyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]pentanamide 5-chloro-N-methyl-N-[(4-oxo-3H-t…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Enamine BB Make on Demand

    • BBV-32166908

  • UORSY BB Make-on-demand

    • BBV-32166908

  Draw Identity 99% 90% 80% 70%

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	1.63	6.5	-17.65	1	5	0	66	313.81	6	↓ MOL2 SDF SMILES Flexibase
  Hi High (pH 8-9.5)	2.08	3.72	-52.05	0	5	-1	69	312.802	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC37829563
• 14371654
  

  Analogs

  14371655

  

  14371656

  

  14371657

  

  37803742

  

  37803745

  

  Popular Name: (1S,2R)-N,2-dimethyl-N-[(4-oxo-3H-thieno[3,2-d]pyrimidin-2-yl)methyl]cyclopropane-1-carboxamide (1S,2R)-N,2-dimethyl-N-[(4-oxo-3…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 47139324

  Draw Identity 99% 90% 80% 70%

  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 (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	1.45	5.77	-16.49	1	5	0	66	277.349	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC14371654