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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

Draw Identity 99% 90% 80% 70%

Popular Name: 5-[(3-chlorophenyl)methyl]-2-(1-phenylethylideneaminoamino)thiazol-4-one 5-[(3-chlorophenyl)methyl]-2-(1-…

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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) 4.04 10.74 -8.88 1 4 0 54 357.866 4 ↓

Analogs

12042380
12042380

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Popular Name: (2Z,5R)-5-[(3-methoxyphenyl)methyl]-2-[(E)-(3-methoxy-4-propoxy-phenyl)methylenehydrazono]thiazolidi (2Z,5R)-5-[(3-methoxyphenyl)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) 3.50 9.71 -10.97 1 7 0 82 427.526 9 ↓
Hi High (pH 8-9.5) 4.03 8.69 -44.34 0 7 -1 84 426.518 10 ↓

Analogs

12042378
12042378

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Popular Name: (2Z,5S)-5-[(3-methoxyphenyl)methyl]-2-[(E)-(3-methoxy-4-propoxy-phenyl)methylenehydrazono]thiazolidi (2Z,5S)-5-[(3-methoxyphenyl)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) 3.50 9.72 -11.55 1 7 0 82 427.526 9 ↓
Hi High (pH 8-9.5) 4.03 8.66 -45.88 0 7 -1 84 426.518 10 ↓

Analogs

12042385
12042385

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Popular Name: (2Z,5R)-2-[(E)-(4-hexoxyphenyl)methylenehydrazono]-5-[(3-methoxyphenyl)methyl]thiazolidin-4-one (2Z,5R)-2-[(E)-(4-hexoxyphenyl)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) 5.48 12.15 -9.28 1 6 0 72 439.581 11 ↓

Analogs

12042383
12042383

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Popular Name: (2Z,5S)-2-[(E)-(4-hexoxyphenyl)methylenehydrazono]-5-[(3-methoxyphenyl)methyl]thiazolidin-4-one (2Z,5S)-2-[(E)-(4-hexoxyphenyl)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) 5.48 12.15 -10.18 1 6 0 72 439.581 11 ↓

Analogs

12042390
12042390

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Popular Name: (2Z,5S)-2-[(E)-(4-isopropoxy-3-methoxy-phenyl)methylenehydrazono]-5-[(3-methoxyphenyl)methyl]thiazol (2Z,5S)-2-[(E)-(4-isopropoxy-3-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) 3.36 9.52 -11.7 1 7 0 82 427.526 8 ↓
Hi High (pH 8-9.5) 3.89 8.47 -46.01 0 7 -1 84 426.518 9 ↓

Analogs

12042387
12042387

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Popular Name: (2Z,5R)-2-[(E)-(4-isopropoxy-3-methoxy-phenyl)methylenehydrazono]-5-[(3-methoxyphenyl)methyl]thiazol (2Z,5R)-2-[(E)-(4-isopropoxy-3-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) 3.36 9.52 -11.07 1 7 0 82 427.526 8 ↓
Hi High (pH 8-9.5) 3.89 8.49 -44.67 0 7 -1 84 426.518 9 ↓

Analogs

12042396
12042396

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Popular Name: (2Z,5R)-2-[(E)-(4-hexoxy-3-methoxy-phenyl)methylenehydrazono]-5-[(3-methoxyphenyl)methyl]thiazolidin (2Z,5R)-2-[(E)-(4-hexoxy-3-metho…

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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) 5.07 12.05 -10.83 1 7 0 82 469.607 12 ↓
Hi High (pH 8-9.5) 5.60 11.02 -44.1 0 7 -1 84 468.599 13 ↓

Analogs

12042393
12042393

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Popular Name: (2Z,5S)-2-[(E)-(4-hexoxy-3-methoxy-phenyl)methylenehydrazono]-5-[(3-methoxyphenyl)methyl]thiazolidin (2Z,5S)-2-[(E)-(4-hexoxy-3-metho…

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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) 5.07 12.06 -11.37 1 7 0 82 469.607 12 ↓
Hi High (pH 8-9.5) 5.60 10.99 -45.66 0 7 -1 84 468.599 13 ↓

Analogs

12042401
12042401

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Popular Name: (2Z,5R)-2-[(E)-(4-butoxy-3-methoxy-phenyl)methylenehydrazono]-5-[(3-methoxyphenyl)methyl]thiazolidin (2Z,5R)-2-[(E)-(4-butoxy-3-metho…

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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) 4.06 10.49 -10.91 1 7 0 82 441.553 10 ↓
Hi High (pH 8-9.5) 4.59 9.44 -43.85 0 7 -1 84 440.545 11 ↓

Analogs

12042399
12042399

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Popular Name: (2Z,5S)-2-[(E)-(4-butoxy-3-methoxy-phenyl)methylenehydrazono]-5-[(3-methoxyphenyl)methyl]thiazolidin (2Z,5S)-2-[(E)-(4-butoxy-3-metho…

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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) 4.06 10.5 -11.45 1 7 0 82 441.553 10 ↓
Hi High (pH 8-9.5) 4.59 9.45 -45.02 0 7 -1 84 440.545 11 ↓

Analogs

12042404
12042404

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Popular Name: (2Z,5R)-5-[(2,6-dichlorophenyl)methyl]-2-[(E)-(4-hexoxyphenyl)methylenehydrazono]thiazolidin-4-one (2Z,5R)-5-[(2,6-dichlorophenyl)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) 6.71 13.51 -8.44 1 5 0 63 478.445 10 ↓
Hi High (pH 8-9.5) 7.24 12.46 -45.97 0 5 -1 65 477.437 11 ↓

Analogs

12042402
12042402

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Popular Name: (2Z,5S)-5-[(2,6-dichlorophenyl)methyl]-2-[(E)-(4-hexoxyphenyl)methylenehydrazono]thiazolidin-4-one (2Z,5S)-5-[(2,6-dichlorophenyl)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) 6.71 13.52 -8.45 1 5 0 63 478.445 10 ↓
Hi High (pH 8-9.5) 7.24 12.47 -45.97 0 5 -1 65 477.437 11 ↓

Analogs

33746624
33746624
33746626
33746626
39888110
39888110
39888217
39888217
40147707
40147707

Draw Identity 99% 90% 80% 70%

Popular Name: (2Z,5S)-5-[(2,6-dichlorophenyl)methyl]-2-[(E)-(4-hexoxy-3-methoxy-phenyl)methylenehydrazono]thiazoli (2Z,5S)-5-[(2,6-dichlorophenyl)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) 6.30 13.43 -9.85 1 6 0 72 508.471 11 ↓
Hi High (pH 8-9.5) 6.83 12.34 -45.31 0 6 -1 74 507.463 12 ↓

Analogs

12042411
12042411

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Popular Name: (2Z,5R)-2-[(E)-(4-butoxyphenyl)methylenehydrazono]-5-[(2,6-dichlorophenyl)methyl]thiazolidin-4-one (2Z,5R)-2-[(E)-(4-butoxyphenyl)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) 5.70 11.95 -8.45 1 5 0 63 450.391 8 ↓

Analogs

12042409
12042409

Draw Identity 99% 90% 80% 70%

Popular Name: (2Z,5S)-2-[(E)-(4-butoxyphenyl)methylenehydrazono]-5-[(2,6-dichlorophenyl)methyl]thiazolidin-4-one (2Z,5S)-2-[(E)-(4-butoxyphenyl)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) 5.70 11.96 -8.46 1 5 0 63 450.391 8 ↓

Analogs

12843806
12843806

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Popular Name: 2-hydroxybenzaldehyde [5-(4-chlorobenzyl)-4-oxo-1,3-thiazolidin-2-ylidene]hydrazone 2-hydroxybenzaldehyde [5-(4-chlo…

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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 7.53 -9.57 2 5 0 74 359.838 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2Z,5R)-2-[(Z)-(4-hydroxyphenyl)methylenehydrazono]-5-[(2-nitrophenyl)methyl]thiazolidin-4-one (2Z,5R)-2-[(Z)-(4-hydroxyphenyl)…

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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 7.23 -14.81 2 8 0 120 370.39 5 ↓

Analogs

18209075
18209075

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Popular Name: 2-benzylideneaminoimino-5-[(4-fluorophenyl)methyl]thiazolidin-4-one 2-benzylideneaminoimino-5-[(4-fl…

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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) 3.11 9.56 -8.92 1 4 0 54 327.384 4 ↓

Analogs

4888920
4888920

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Popular Name: 2-[(2-chlorophenyl)methyleneaminoimino]-5-[(4-methoxyphenyl)methyl]thiazolidin-4-one 2-[(2-chlorophenyl)methyleneamin…

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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 0.5 -10.97 1 5 0 63 373.865 5 ↓

Analogs

4888919
4888919

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Popular Name: 2-[(2-chlorophenyl)methyleneaminoimino]-5-[(4-methoxyphenyl)methyl]thiazolidin-4-one 2-[(2-chlorophenyl)methyleneamin…

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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 0.53 -11.14 1 5 0 63 373.865 5 ↓

Analogs

5048079
5048079
6191971
6191971

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Popular Name: 2-[(4-chlorophenyl)methyleneaminoimino]-5-[(4-fluorophenyl)methyl]thiazolidin-4-one 2-[(4-chlorophenyl)methyleneamin…

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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) 3.78 0.93 -8.69 1 4 0 53 361.829 4 ↓

Parameters Provided:

ring.id = 1634
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 = 1634 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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