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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

1152826
1152826

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Popular Name: N-[5-[(3-bromo-4,5-dimethoxy-phenyl)methylene]-4-oxo-thiazol-2-yl]acetamide N-[5-[(3-bromo-4,5-dimethoxy-phe…

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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) 2.89 3.81 -12.04 1 6 0 81 385.239 3 ↓

Analogs

5061414
5061414

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Popular Name: N-[4-oxo-5-[(3,4,5-trimethoxyphenyl)methylene]thiazol-2-yl]acetamide N-[4-oxo-5-[(3,4,5-trimethoxyphe…

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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) 1.94 2.98 -14.11 1 7 0 90 336.369 4 ↓

Analogs

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Popular Name: N-[5-[(3,5-dichloro-2-methoxy-phenyl)methylene]-4-oxo-thiazol-2-yl]acetamide N-[5-[(3,5-dichloro-2-methoxy-ph…

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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) 3.57 4.37 -7.83 1 5 0 72 345.207 2 ↓

Analogs

5050723
5050723

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Popular Name: N-[5-[(4-methoxyphenyl)methylene]-4-oxo-thiazol-2-yl]acetamide N-[5-[(4-methoxyphenyl)methylene…

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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) 2.36 3.06 -12.21 1 5 0 72 276.317 2 ↓

Analogs

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Popular Name: 2-[2-methoxy-4-[(Z)-[(2E)-3-methyl-2-methylimino-4-oxo-thiazolidin-5-ylidene]methyl]phenoxy]acetic 2-[2-methoxy-4-[(Z)-[(2E)-3-meth…

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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) 1.90 5.67 -52.82 0 7 -1 93 335.361 5 ↓

Analogs

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Popular Name: 5-(2,5-Dimethoxybenzylidene)-2-iminothiazolidin-4-one 5-(2,5-Dimethoxybenzylidene)-2-i…

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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) 1.18 2.75 -8.01 2 5 0 75 264.306 3 ↓

Analogs

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Popular Name: (5E)-5-[(4-hydroxy-3,5-dimethoxy-phenyl)methylene]-2-imino-thiazolidin-4-one (5E)-5-[(4-hydroxy-3,5-dimethoxy…

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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) 0.49 1.18 -11.18 3 6 0 95 280.305 3 ↓
Hi High (pH 8-9.5) 0.95 -0.58 -41.86 2 6 -1 98 279.297 3 ↓
Hi High (pH 8-9.5) 1.00 0.32 -40.87 2 6 -1 92 279.297 3 ↓

Analogs

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Popular Name: (5Z)-5-[(3,5-dibromo-2-hydroxy-4-methoxy-phenyl)methylene]-2-imino-thiazolidin-4-one (5Z)-5-[(3,5-dibromo-2-hydroxy-4…

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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) 2.37 1.8 -6.94 3 5 0 86 408.071 2 ↓
Hi High (pH 8-9.5) 2.88 1.58 -86.21 1 5 -2 86 406.055 2 ↓
Mid Mid (pH 6-8) 2.37 2.58 -32.18 2 5 -1 89 407.063 2 ↓

Analogs

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Popular Name: 2-[2-ethoxy-4-[(E)-[(2E)-3-methyl-2-methylimino-4-oxo-thiazolidin-5-ylidene]methyl]phenoxy]acetamide 2-[2-ethoxy-4-[(E)-[(2E)-3-methy…

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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) 1.77 3.89 -17.78 2 7 0 96 349.412 6 ↓

Analogs

15985834
15985834

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Popular Name: ethyl 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) 4.80 9.66 -11.74 0 6 0 70 441.347 8 ↓
Ref Reference (pH 7) 4.80 10.2 -11.1 0 6 0 70 441.347 8 ↓

Analogs

5523084
5523084

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Popular Name: (2Z,5Z)-5-(3,5-ditert-butyl-4-hydroxy-benzylidene)-3-ethyl-2-ethylimino-thiazolidin-4-one (2Z,5Z)-5-(3,5-ditert-butyl-4-hy…

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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) 6.81 0.85 -6.59 1 4 0 54 388.577 5 ↓

Analogs

15013252
15013252

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Popular Name: 5-[(3-iodo-4-methoxy-phenyl)methylene]-3-methyl-2-methylimino-thiazolidin-4-one 5-[(3-iodo-4-methoxy-phenyl)meth…

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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) 4.08 -2.24 -10.06 0 4 0 43 388.23 2 ↓

Analogs

13635503
13635503

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Popular Name: 3-allyl-2-allylimino-5-[(3-nitrophenyl)methylene]thiazolidin-4-one 3-allyl-2-allylimino-5-[(3-nitro…

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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) 4.24 0.22 -8.65 0 6 0 80 329.381 6 ↓

Analogs

16676511
16676511
17164612
17164612
5372374
5372374
5372383
5372383
5372386
5372386

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Popular Name: (2E,5E)-3-ethyl-2-ethylimino-5-(p-tolylmethylene)thiazolidin-4-one (2E,5E)-3-ethyl-2-ethylimino-5-(…

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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) 4.21 7.85 -6.95 0 3 0 34 274.389 3 ↓

Analogs

4695943
4695943

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Popular Name: (2Z,5Z)-3-ethyl-2-ethylimino-5-[(4-hydroxy-3-methoxy-5-nitro-phenyl)methylene]thiazolidin-4-one (2Z,5Z)-3-ethyl-2-ethylimino-5-[…

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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) 3.22 5.39 -14.4 1 8 0 110 351.384 5 ↓
Mid Mid (pH 6-8) 3.22 6.46 -48.31 0 8 -1 112 350.376 5 ↓

Analogs

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Popular Name: (NZ)-N-[(5E)-5-[(3-nitrophenyl)methylene]-4-oxo-thiazolidin-2-ylidene]acetamide (NZ)-N-[(5E)-5-[(3-nitrophenyl)m…

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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) 2.24 4.78 -13.66 1 7 0 108 291.288 2 ↓
Hi High (pH 8-9.5) 2.70 2.88 -37.37 0 7 -1 111 290.28 2 ↓
Hi High (pH 8-9.5) 2.70 3.44 -43.33 0 7 -1 111 290.28 2 ↓

Parameters Provided:

ring.id = 1851
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 = 1851 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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