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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 4-(2-oxochromen-3-yl)-9-[[(2S)-tetrahydrofuran-2-yl]methyl]-8,10-dihydropyrano[2,3-f][1,3]benzoxazin 4-(2-oxochromen-3-yl)-9-[[(2S)-t…

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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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.73 9.34 -17.61 0 7 0 82 431.444 3 ↓
Lo Low (pH 4.5-6) 3.73 12.21 -47.01 1 7 1 83 432.452 3 ↓

Analogs

12442432
12442432
12442434
12442434

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Popular Name: 4-(2-oxochromen-3-yl)-9-[[(2R)-tetrahydrofuran-2-yl]methyl]-8,10-dihydropyrano[2,3-f][1,3]benzoxazin 4-(2-oxochromen-3-yl)-9-[[(2R)-t…

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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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.73 9.28 -17.46 0 7 0 82 431.444 3 ↓
Lo Low (pH 4.5-6) 3.73 12.18 -46.22 1 7 1 83 432.452 3 ↓

Analogs

12442434
12442434
12442432
12442432

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Popular Name: 4-(6-chloro-2-oxo-chromen-3-yl)-9-[[(2S)-tetrahydrofuran-2-yl]methyl]-8,10-dihydropyrano[2,3-f][1,3] 4-(6-chloro-2-oxo-chromen-3-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.38 9.85 -15.68 0 7 0 82 465.889 3 ↓
Lo Low (pH 4.5-6) 4.38 12.72 -45.87 1 7 1 83 466.897 3 ↓

Analogs

12442434
12442434
12442432
12442432

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(6-chloro-2-oxo-chromen-3-yl)-9-[[(2R)-tetrahydrofuran-2-yl]methyl]-8,10-dihydropyrano[2,3-f][1,3] 4-(6-chloro-2-oxo-chromen-3-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.38 9.78 -15.52 0 7 0 82 465.889 3 ↓
Lo Low (pH 4.5-6) 4.38 12.69 -45.04 1 7 1 83 466.897 3 ↓

Analogs

12442432
12442432
12442434
12442434

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Popular Name: 4-(6-bromo-2-oxo-chromen-3-yl)-9-[[(2S)-tetrahydrofuran-2-yl]methyl]-8,10-dihydropyrano[2,3-f][1,3]b 4-(6-bromo-2-oxo-chromen-3-yl)-9…

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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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.51 9.95 -15.54 0 7 0 82 510.34 3 ↓
Lo Low (pH 4.5-6) 4.51 12.81 -45.7 1 7 1 83 511.348 3 ↓

Analogs

12442432
12442432
12442434
12442434

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(6-bromo-2-oxo-chromen-3-yl)-9-[[(2R)-tetrahydrofuran-2-yl]methyl]-8,10-dihydropyrano[2,3-f][1,3]b 4-(6-bromo-2-oxo-chromen-3-yl)-9…

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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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.51 9.89 -15.4 0 7 0 82 510.34 3 ↓
Lo Low (pH 4.5-6) 4.51 12.79 -44.87 1 7 1 83 511.348 3 ↓

Analogs

12442434
12442434
12442432
12442432

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Popular Name: 4-(8-methoxy-2-oxo-chromen-3-yl)-9-[[(2S)-tetrahydrofuran-2-yl]methyl]-8,10-dihydropyrano[2,3-f][1,3 4-(8-methoxy-2-oxo-chromen-3-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.74 9.03 -20.97 0 8 0 91 461.47 4 ↓
Lo Low (pH 4.5-6) 3.74 11.9 -50.28 1 8 1 93 462.478 4 ↓

Analogs

12442434
12442434
12442432
12442432

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(8-methoxy-2-oxo-chromen-3-yl)-9-[[(2R)-tetrahydrofuran-2-yl]methyl]-8,10-dihydropyrano[2,3-f][1,3 4-(8-methoxy-2-oxo-chromen-3-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.74 8.97 -20.74 0 8 0 91 461.47 4 ↓
Lo Low (pH 4.5-6) 3.74 11.88 -49.57 1 8 1 93 462.478 4 ↓

Analogs

12442432
12442432
12442434
12442434

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(8-ethoxy-2-oxo-chromen-3-yl)-9-[[(2S)-tetrahydrofuran-2-yl]methyl]-8,10-dihydropyrano[2,3-f][1,3] 4-(8-ethoxy-2-oxo-chromen-3-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.11 9.95 -20.92 0 8 0 91 475.497 5 ↓
Lo Low (pH 4.5-6) 4.11 12.82 -50.24 1 8 1 93 476.505 5 ↓

Analogs

12442432
12442432
12442434
12442434

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(8-ethoxy-2-oxo-chromen-3-yl)-9-[[(2R)-tetrahydrofuran-2-yl]methyl]-8,10-dihydropyrano[2,3-f][1,3] 4-(8-ethoxy-2-oxo-chromen-3-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.11 9.9 -20.78 0 8 0 91 475.497 5 ↓
Lo Low (pH 4.5-6) 4.11 12.79 -49.51 1 8 1 93 476.505 5 ↓

Parameters Provided:

ring.id = 564350
filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

SQL Query Was

SELECT DISTINCT(ci.sub_id_fk) AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id INNER JOIN hasring AS hr ON ci.sub_id_fk=hr.sub_id_fk INNER JOIN rings AS r ON hr.rings_fk=r.rings_id  WHERE r.rings_id = 564350 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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