ZINC 12

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.58	7.93	-10.11	0	5	0	52	346.452	7	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	1.58	8.39	-33.91	1	5	1	53	347.46	7	↓ MOL2 SDF SMILES Flexibase

69512333

Analogs

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Popular Name: 2-[(4S)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-N-(2-methoxyethyl)-N-(2-pyridylmethyl)acetamide 2-[(4S)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.58	7.94	-10.36	0	5	0	52	346.452	7	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	1.58	8.4	-35.98	1	5	1	53	347.46	7	↓ MOL2 SDF SMILES Flexibase

69571408

Analogs

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Popular Name: 2-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-(3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyr 2-[(4R)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.34	7.89	-15.15	0	6	0	60	318.402	2	↓ MOL2 SDF SMILES Flexibase

69571409

Analogs

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Popular Name: 2-[(4S)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-(3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyr 2-[(4S)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.34	7.89	-16.07	0	6	0	60	318.402	2	↓ MOL2 SDF SMILES Flexibase

69706835

Analogs

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Popular Name: 2-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-[4-[(2S)-2-hydroxypropyl]piperazin-1-yl]ethanone 2-[(4R)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.99	3.28	-11.48	1	5	0	53	324.446	4	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	0.99	5.49	-46.82	2	5	1	54	325.454	4	↓ MOL2 SDF SMILES Flexibase

69706839

Analogs

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Popular Name: 2-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-[4-[(2R)-2-hydroxypropyl]piperazin-1-yl]ethanone 2-[(4R)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.99	3.23	-11.15	1	5	0	53	324.446	4	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	0.99	5.47	-47.93	2	5	1	54	325.454	4	↓ MOL2 SDF SMILES Flexibase

69706842

Analogs

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Popular Name: 2-[(4S)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-[4-[(2S)-2-hydroxypropyl]piperazin-1-yl]ethanone 2-[(4S)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.99	3.16	-11.16	1	5	0	53	324.446	4	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	0.99	5.44	-47.97	2	5	1	54	325.454	4	↓ MOL2 SDF SMILES Flexibase

69706846

Analogs

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Popular Name: 2-[(4S)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-[4-[(2R)-2-hydroxypropyl]piperazin-1-yl]ethanone 2-[(4S)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.99	3.25	-11.55	1	5	0	53	324.446	4	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	0.99	5.49	-46.8	2	5	1	54	325.454	4	↓ MOL2 SDF SMILES Flexibase

65564894

Analogs

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Popular Name: 2-(5-amino-4-cyano-pyrazol-1-yl)ethyl 2-(5-amino-4-cyano-pyrazol-1-yl)…

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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)	1.20	5.7	-13.2	2	7	0	103	318.358	5	↓ MOL2 SDF SMILES Flexibase

69738797

Analogs

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Popular Name: 6,7-dihydro-4H-thieno[3,2-c]pyran-2-yl-[(2S)-2-(1-methylpyrazol-4-yl)pyrrolidin-1-yl]methanone 6,7-dihydro-4H-thieno[3,2-c]pyra…

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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)	1.80	6.45	-15.15	0	5	0	47	317.414	2	↓ MOL2 SDF SMILES Flexibase

69738798

Analogs

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Popular Name: 6,7-dihydro-4H-thieno[3,2-c]pyran-2-yl-[(2R)-2-(1-methylpyrazol-4-yl)pyrrolidin-1-yl]methanone 6,7-dihydro-4H-thieno[3,2-c]pyra…

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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)	1.80	6.45	-14.88	0	5	0	47	317.414	2	↓ MOL2 SDF SMILES Flexibase

69770228

Analogs

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Popular Name: 2-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-[(3R)-3-(4-methylpyrazol-1-yl)-1-piperidyl]ethanon 2-[(4R)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.21	8.79	-16.17	0	5	0	47	345.468	3	↓ MOL2 SDF SMILES Flexibase

69770230

Analogs

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Popular Name: 2-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-[(3S)-3-(4-methylpyrazol-1-yl)-1-piperidyl]ethanon 2-[(4R)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.21	8.78	-16.57	0	5	0	47	345.468	3	↓ MOL2 SDF SMILES Flexibase

69770233

Analogs

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Popular Name: 2-[(4S)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-[(3R)-3-(4-methylpyrazol-1-yl)-1-piperidyl]ethanon 2-[(4S)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.21	8.79	-16.56	0	5	0	47	345.468	3	↓ MOL2 SDF SMILES Flexibase

69770235

Analogs

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Popular Name: 2-[(4S)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-[(3S)-3-(4-methylpyrazol-1-yl)-1-piperidyl]ethanon 2-[(4S)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.21	8.78	-16.17	0	5	0	47	345.468	3	↓ MOL2 SDF SMILES Flexibase

69772930

Analogs

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Popular Name: 2-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-[(3R)-3-(2-methylimidazol-1-yl)-1-piperidyl]ethano 2-[(4R)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.53	9.99	-35.68	1	5	1	49	346.476	3	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	1.53	9.51	-15.3	0	5	0	47	345.468	3	↓ MOL2 SDF SMILES Flexibase

69772934

Analogs

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Popular Name: 2-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-[(3S)-3-(2-methylimidazol-1-yl)-1-piperidyl]ethano 2-[(4R)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.53	9.99	-35.09	1	5	1	49	346.476	3	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	1.53	9.51	-15.17	0	5	0	47	345.468	3	↓ MOL2 SDF SMILES Flexibase

69772936

Analogs

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Popular Name: 2-[(4S)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-[(3R)-3-(2-methylimidazol-1-yl)-1-piperidyl]ethano 2-[(4S)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.53	9.99	-35.1	1	5	1	49	346.476	3	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	1.53	9.51	-15.11	0	5	0	47	345.468	3	↓ MOL2 SDF SMILES Flexibase

69772939

Analogs

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Popular Name: 2-[(4S)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-[(3S)-3-(2-methylimidazol-1-yl)-1-piperidyl]ethano 2-[(4S)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.53	9.99	-35.71	1	5	1	49	346.476	3	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	1.53	9.51	-15.34	0	5	0	47	345.468	3	↓ MOL2 SDF SMILES Flexibase

69808973

Analogs

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Popular Name: 2-[(4S)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-[(3S)-3-imidazol-1-yl-1-piperidyl]ethanone 2-[(4S)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.44	10.22	-38.65	1	5	1	49	332.449	3	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	1.44	9.51	-14.77	0	5	0	47	331.441	3	↓ MOL2 SDF SMILES Flexibase

69808976

Analogs

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Popular Name: 2-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-[(3S)-3-imidazol-1-yl-1-piperidyl]ethanone 2-[(4R)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.44	10.22	-37.93	1	5	1	49	332.449	3	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	1.44	9.51	-14.61	0	5	0	47	331.441	3	↓ MOL2 SDF SMILES Flexibase

69808981

Analogs

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Popular Name: 2-[(4S)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-[(3R)-3-imidazol-1-yl-1-piperidyl]ethanone 2-[(4S)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.44	10.24	-37.93	1	5	1	49	332.449	3	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	1.44	9.54	-14.65	0	5	0	47	331.441	3	↓ MOL2 SDF SMILES Flexibase

69808984

Analogs

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Popular Name: 2-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-[(3R)-3-imidazol-1-yl-1-piperidyl]ethanone 2-[(4R)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.44	10.24	-38.69	1	5	1	49	332.449	3	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	1.44	9.54	-14.78	0	5	0	47	331.441	3	↓ MOL2 SDF SMILES Flexibase

69840994

Analogs

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Popular Name: 2-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-(3-isopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a] 2-[(4R)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.40	8.95	-14.43	0	6	0	60	346.456	3	↓ MOL2 SDF SMILES Flexibase

69840996

Analogs

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Popular Name: 2-[(4S)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-(3-isopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a] 2-[(4S)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.40	8.95	-15.31	0	6	0	60	346.456	3	↓ MOL2 SDF SMILES Flexibase

69844177

Analogs

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Popular Name: 6,7-dihydro-4H-thieno[3,2-c]pyran-2-yl-[4-(2-hydroxy-2-methyl-propyl)piperazin-1-yl]methanone 6,7-dihydro-4H-thieno[3,2-c]pyra…

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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)	1.51	2.94	-9.34	1	5	0	53	324.446	3	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	1.51	4.68	-48.38	2	5	1	54	325.454	3	↓ MOL2 SDF SMILES Flexibase

69899344

Analogs

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Popular Name: 6,7-dihydro-4H-thieno[3,2-c]pyran-2-yl-[(2S)-2-[(2R)-1-ethylpyrrolidin-2-yl]pyrrolidin-1-yl]methanon 6,7-dihydro-4H-thieno[3,2-c]pyra…

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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)	2.62	7.69	-38.58	1	4	1	34	335.493	3	↓ MOL2 SDF SMILES Flexibase

69899347

Analogs

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Popular Name: 6,7-dihydro-4H-thieno[3,2-c]pyran-2-yl-[(2S)-2-[(2S)-1-ethylpyrrolidin-2-yl]pyrrolidin-1-yl]methanon 6,7-dihydro-4H-thieno[3,2-c]pyra…

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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)	2.62	8	-37.26	1	4	1	34	335.493	3	↓ MOL2 SDF SMILES Flexibase

69921938

Analogs

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Popular Name: 6,7-dihydro-4H-thieno[3,2-c]pyran-2-yl-(3-isopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-y 6,7-dihydro-4H-thieno[3,2-c]pyra…

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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)	1.47	7.11	-13.79	0	6	0	60	332.429	2	↓ MOL2 SDF SMILES Flexibase

69923319

Analogs

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Popular Name: 6,7-dihydro-4H-thieno[3,2-c]pyran-2-yl-[(3R)-3-(2-methylimidazol-1-yl)-1-piperidyl]methanone 6,7-dihydro-4H-thieno[3,2-c]pyra…

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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)	1.60	8.25	-38.51	1	5	1	49	332.449	2	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	1.60	7.78	-11.59	0	5	0	47	331.441	2	↓ MOL2 SDF SMILES Flexibase

69923322

Analogs

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Popular Name: 6,7-dihydro-4H-thieno[3,2-c]pyran-2-yl-[(3S)-3-(2-methylimidazol-1-yl)-1-piperidyl]methanone 6,7-dihydro-4H-thieno[3,2-c]pyra…

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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)	1.60	8.19	-40.4	1	5	1	49	332.449	2	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	1.60	7.71	-11.86	0	5	0	47	331.441	2	↓ MOL2 SDF SMILES Flexibase

69930094

Analogs

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Popular Name: 2-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-[4-(2-hydroxy-2-methyl-propyl)piperazin-1-yl]ethan 2-[(4R)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.44	4.87	-11.31	1	5	0	53	338.473	4	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	1.44	6.55	-45.76	2	5	1	54	339.481	4	↓ MOL2 SDF SMILES Flexibase

69930097

Analogs

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Popular Name: 2-[(4S)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-[4-(2-hydroxy-2-methyl-propyl)piperazin-1-yl]ethan 2-[(4S)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.44	4.8	-9.89	1	5	0	53	338.473	4	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	1.44	6.57	-47.49	2	5	1	54	339.481	4	↓ MOL2 SDF SMILES Flexibase

69948623

Analogs

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Popular Name: 6,7-dihydro-4H-thieno[3,2-c]pyran-2-yl-[(2S)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]methanone 6,7-dihydro-4H-thieno[3,2-c]pyra…

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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)	1.90	6.53	-14.88	0	5	0	47	317.414	3	↓ MOL2 SDF SMILES Flexibase

69948625

Analogs

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Popular Name: 6,7-dihydro-4H-thieno[3,2-c]pyran-2-yl-[(2R)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]methanone 6,7-dihydro-4H-thieno[3,2-c]pyra…

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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)	1.90	7.09	-13.58	0	5	0	47	317.414	3	↓ MOL2 SDF SMILES Flexibase

69966629

Analogs

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Popular Name: 6,7-dihydro-4H-thieno[3,2-c]pyran-2-yl-[(2S)-2-(pyrazol-1-ylmethyl)-1-piperidyl]methanone 6,7-dihydro-4H-thieno[3,2-c]pyra…

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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)	2.41	7.27	-9.62	0	5	0	47	331.441	3	↓ MOL2 SDF SMILES Flexibase

69966634

Analogs

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Popular Name: 6,7-dihydro-4H-thieno[3,2-c]pyran-2-yl-[(2R)-2-(pyrazol-1-ylmethyl)-1-piperidyl]methanone 6,7-dihydro-4H-thieno[3,2-c]pyra…

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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)	2.41	7.42	-9.33	0	5	0	47	331.441	3	↓ MOL2 SDF SMILES Flexibase

69971449

Analogs

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Popular Name: 2-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-[(2S)-2-(pyrazol-1-ylmethyl)-1-piperidyl]ethanone 2-[(4R)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.34	8.99	-10.37	0	5	0	47	345.468	4	↓ MOL2 SDF SMILES Flexibase

69971454

Analogs

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Popular Name: 2-[(4R)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-[(2R)-2-(pyrazol-1-ylmethyl)-1-piperidyl]ethanone 2-[(4R)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.34	9.01	-9.93	0	5	0	47	345.468	4	↓ MOL2 SDF SMILES Flexibase

69971458

Analogs

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Popular Name: 2-[(4S)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-[(2S)-2-(pyrazol-1-ylmethyl)-1-piperidyl]ethanone 2-[(4S)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.34	9	-11.02	0	5	0	47	345.468	4	↓ MOL2 SDF SMILES Flexibase

69971462

Analogs

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Popular Name: 2-[(4S)-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl]-1-[(2R)-2-(pyrazol-1-ylmethyl)-1-piperidyl]ethanone 2-[(4S)-6,7-dihydro-4H-thieno[3,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.34	9.01	-10.49	0	5	0	47	345.468	4	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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SQL Query Was

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