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

Analogs

38733892
38733892
38712476
38712476
38712478
38712478
1131546
1131546

Draw Identity 99% 90% 80% 70%

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

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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) 3.19 9.77 -10.67 0 6 0 76 389.436 3 ↓
Lo Low (pH 4.5-6) 3.19 10.22 -36.52 1 6 1 78 390.444 3 ↓

Analogs

38712476
38712476
38712478
38712478
38733890
38733890
1131546
1131546

Draw Identity 99% 90% 80% 70%

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

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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) 3.19 9.76 -10.6 0 6 0 76 389.436 3 ↓
Lo Low (pH 4.5-6) 3.19 10.22 -37.2 1 6 1 78 390.444 3 ↓

Analogs

38733901
38733901
38718261
38718261
38718264
38718264
6571332
6571332
6571334
6571334

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-2-(4,5-dimethylthiazol-2-yl)-7-ethyl-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1R)-2-(4,5-dimethylthiazol-2-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) 3.63 11.12 -11.04 0 6 0 76 417.49 3 ↓
Lo Low (pH 4.5-6) 3.63 11.58 -36.48 1 6 1 78 418.498 3 ↓

Analogs

38718261
38718261
38718264
38718264
38733898
38733898
6571332
6571332

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-2-(4,5-dimethylthiazol-2-yl)-7-ethyl-1-(4-pyridyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (1S)-2-(4,5-dimethylthiazol-2-yl…

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Activity (Go SEA)

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) 3.63 11.1 -10.95 0 6 0 76 417.49 3 ↓
Lo Low (pH 4.5-6) 3.63 11.56 -37.16 1 6 1 78 418.498 3 ↓

Parameters Provided:

ring.id = 598920
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 = 598920 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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