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

Analogs

38730236
38730236

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-7-ethyl-2-(2-methoxyethyl)-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1R)-7-ethyl-2-(2-methoxyethyl)-…

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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) 2.42 8.36 -10.33 0 6 0 73 364.401 5 ↓
Lo Low (pH 4.5-6) 2.42 8.84 -39.74 1 6 1 74 365.409 5 ↓

Analogs

38730231
38730231

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-7-ethyl-2-(2-methoxyethyl)-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1S)-7-ethyl-2-(2-methoxyethyl)-…

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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) 2.42 8.21 -12.67 0 6 0 73 364.401 5 ↓
Lo Low (pH 4.5-6) 2.42 8.67 -45.21 1 6 1 74 365.409 5 ↓

Analogs

38730307
38730307

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-2-allyl-7-ethyl-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1R)-2-allyl-7-ethyl-1-(4-pyridy…

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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) 3.08 9.8 -10.08 0 5 0 63 346.386 4 ↓
Lo Low (pH 4.5-6) 3.08 10.25 -41.43 1 5 1 65 347.394 4 ↓

Analogs

38730302
38730302

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-2-allyl-7-ethyl-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1S)-2-allyl-7-ethyl-1-(4-pyridy…

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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) 3.08 9.46 -10.01 0 5 0 63 346.386 4 ↓
Lo Low (pH 4.5-6) 3.08 9.92 -40.81 1 5 1 65 347.394 4 ↓

Analogs

38730339
38730339

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-7-ethyl-2-isobutyl-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1R)-7-ethyl-2-isobutyl-1-(4-pyr…

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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) 3.56 10.57 -9.88 0 5 0 63 362.429 4 ↓
Lo Low (pH 4.5-6) 3.56 11.03 -41.17 1 5 1 65 363.437 4 ↓

Analogs

38730333
38730333

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-7-ethyl-2-isobutyl-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1S)-7-ethyl-2-isobutyl-1-(4-pyr…

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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) 3.56 10.03 -9.71 0 5 0 63 362.429 4 ↓
Lo Low (pH 4.5-6) 3.56 10.49 -41.94 1 5 1 65 363.437 4 ↓

Analogs

38730457
38730457

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-7-ethyl-2-(3-hydroxypropyl)-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1R)-7-ethyl-2-(3-hydroxypropyl)…

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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) 2.08 6.66 -12.46 1 6 0 84 364.401 5 ↓
Lo Low (pH 4.5-6) 2.08 7.12 -44.47 2 6 1 85 365.409 5 ↓

Analogs

38730454
38730454

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-7-ethyl-2-(3-hydroxypropyl)-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1S)-7-ethyl-2-(3-hydroxypropyl)…

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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) 2.08 6.25 -12.82 1 6 0 84 364.401 5 ↓
Lo Low (pH 4.5-6) 2.08 6.71 -42.58 2 6 1 85 365.409 5 ↓

Analogs

38730477
38730477

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-7-ethyl-2-(2-hydroxyethyl)-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1R)-7-ethyl-2-(2-hydroxyethyl)-…

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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) 1.81 5.98 -11.22 1 6 0 84 350.374 4 ↓
Lo Low (pH 4.5-6) 1.81 6.43 -40.06 2 6 1 85 351.382 4 ↓

Analogs

38730474
38730474

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-7-ethyl-2-(2-hydroxyethyl)-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1S)-7-ethyl-2-(2-hydroxyethyl)-…

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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) 1.81 5.83 -13.6 1 6 0 84 350.374 4 ↓
Lo Low (pH 4.5-6) 1.81 6.29 -45.9 2 6 1 85 351.382 4 ↓

Analogs

38733738
38733738
38733743
38733743
38733744
38733744
38733814
38733814
38733817
38733817

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-2-[3-(diethylamino)propyl]-7-ethyl-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1R)-2-[3-(diethylamino)propyl]-…

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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) 3.49 12.66 -43.61 1 6 1 68 420.533 8 ↓
Lo Low (pH 4.5-6) 3.49 13.12 -93.32 2 6 2 69 421.541 8 ↓

Analogs

38733743
38733743
38733744
38733744
38733814
38733814
38733817
38733817
38733737
38733737

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-2-[3-(diethylamino)propyl]-7-ethyl-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1S)-2-[3-(diethylamino)propyl]-…

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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) 3.49 12.21 -41.09 1 6 1 68 420.533 8 ↓
Lo Low (pH 4.5-6) 3.49 12.66 -102.78 2 6 2 69 421.541 8 ↓

Analogs

38733744
38733744
38733814
38733814
38733817
38733817
38733737
38733737
38733738
38733738

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-2-[3-(dimethylamino)propyl]-7-ethyl-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1R)-2-[3-(dimethylamino)propyl]…

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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) 2.74 11.33 -45.12 1 6 1 68 392.479 6 ↓
Lo Low (pH 4.5-6) 2.74 11.78 -93.52 2 6 2 69 393.487 6 ↓

Analogs

38733814
38733814
38733817
38733817
38733737
38733737
38733738
38733738
38733743
38733743

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-2-[3-(dimethylamino)propyl]-7-ethyl-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1S)-2-[3-(dimethylamino)propyl]…

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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) 2.74 10.92 -43.22 1 6 1 68 392.479 6 ↓
Lo Low (pH 4.5-6) 2.74 11.38 -103.27 2 6 2 69 393.487 6 ↓

Analogs

38733794
38733794
40561914
40561914
40561916
40561916
38730021
38730021
38730023
38730023

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-7-ethyl-2-methyl-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1R)-7-ethyl-2-methyl-1-(4-pyrid…

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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) 2.44 8.26 -10.63 0 5 0 63 320.348 2 ↓
Lo Low (pH 4.5-6) 2.44 8.72 -40.88 1 5 1 65 321.356 2 ↓

Analogs

40561914
40561914
40561916
40561916
38730021
38730021
38730023
38730023
38733792
38733792

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-7-ethyl-2-methyl-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1S)-7-ethyl-2-methyl-1-(4-pyrid…

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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) 2.44 8.26 -10.45 0 5 0 63 320.348 2 ↓
Lo Low (pH 4.5-6) 2.44 8.71 -41.4 1 5 1 65 321.356 2 ↓

Analogs

38733817
38733817
38733737
38733737
38733738
38733738
38733743
38733743
38733744
38733744

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-7-ethyl-2-propyl-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1R)-7-ethyl-2-propyl-1-(4-pyrid…

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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) 3.32 9.96 -10.01 0 5 0 63 348.402 4 ↓
Lo Low (pH 4.5-6) 3.32 10.42 -41.93 1 5 1 65 349.41 4 ↓

Analogs

38733814
38733814
38733737
38733737
38733738
38733738
38733743
38733743
38733744
38733744

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-7-ethyl-2-propyl-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1S)-7-ethyl-2-propyl-1-(4-pyrid…

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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) 3.32 9.59 -10.36 0 5 0 63 348.402 4 ↓
Lo Low (pH 4.5-6) 3.32 10.05 -41.28 1 5 1 65 349.41 4 ↓

Analogs

38733850
38733850

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-2-butyl-7-ethyl-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1R)-2-butyl-7-ethyl-1-(4-pyridy…

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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) 3.88 10.74 -9.92 0 5 0 63 362.429 5 ↓
Lo Low (pH 4.5-6) 3.88 11.2 -42.25 1 5 1 65 363.437 5 ↓

Analogs

38733848
38733848

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-2-butyl-7-ethyl-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1S)-2-butyl-7-ethyl-1-(4-pyridy…

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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) 3.88 10.37 -10.32 0 5 0 63 362.429 5 ↓
Lo Low (pH 4.5-6) 3.88 10.83 -41.6 1 5 1 65 363.437 5 ↓

Analogs

38733861
38733861
38733871
38733871
38733873
38733873

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-7-ethyl-2-(3-methoxypropyl)-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1R)-7-ethyl-2-(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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.69 9.06 -11.58 0 6 0 73 378.428 6 ↓
Lo Low (pH 4.5-6) 2.69 9.52 -43.73 1 6 1 74 379.436 6 ↓

Analogs

38733871
38733871
38733873
38733873
38733859
38733859

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-7-ethyl-2-(3-methoxypropyl)-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1S)-7-ethyl-2-(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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.69 8.66 -11.78 0 6 0 73 378.428 6 ↓
Lo Low (pH 4.5-6) 2.69 9.11 -41.98 1 6 1 74 379.436 6 ↓

Analogs

38733873
38733873
38733859
38733859
38733861
38733861

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-2-(3-ethoxypropyl)-7-ethyl-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1R)-2-(3-ethoxypropyl)-7-ethyl-…

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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) 3.07 10.03 -11.51 0 6 0 73 392.455 7 ↓
Lo Low (pH 4.5-6) 3.07 10.49 -43.55 1 6 1 74 393.463 7 ↓

Analogs

38733859
38733859
38733861
38733861
38733871
38733871

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-2-(3-ethoxypropyl)-7-ethyl-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1S)-2-(3-ethoxypropyl)-7-ethyl-…

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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) 3.07 9.62 -11.8 0 6 0 73 392.455 7 ↓
Lo Low (pH 4.5-6) 3.07 10.08 -41.84 1 6 1 74 393.463 7 ↓

Parameters Provided:

ring.id = 597672
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 = 597672 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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