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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

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Popular Name: (4R)-N-(4-methoxyphenyl)-4-phenyl-4,5-dihydrothiazol-2-amine (4R)-N-(4-methoxyphenyl)-4-pheny…

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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 8.22 -29.66 2 3 1 35 285.392 4 ↓
Mid Mid (pH 6-8) 3.73 7.78 -8.34 1 3 0 34 284.384 3 ↓

Analogs

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Popular Name: (4S)-N-(4-methoxyphenyl)-4-phenyl-4,5-dihydrothiazol-2-amine (4S)-N-(4-methoxyphenyl)-4-pheny…

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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 8.21 -29.49 2 3 1 35 285.392 4 ↓
Mid Mid (pH 6-8) 3.73 7.79 -8.15 1 3 0 34 284.384 3 ↓

Analogs

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Popular Name: (4R)-4-phenyl-N-(2,4,6-trimethylphenyl)-4,5-dihydrothiazol-2-amine (4R)-4-phenyl-N-(2,4,6-trimethyl…

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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) 3.94 11.49 -26.82 2 2 1 26 297.447 3 ↓
Mid Mid (pH 6-8) 4.88 11.09 -7.42 1 2 0 24 296.439 2 ↓

Analogs

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Popular Name: (4S)-4-phenyl-N-(2,4,6-trimethylphenyl)-4,5-dihydrothiazol-2-amine (4S)-4-phenyl-N-(2,4,6-trimethyl…

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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) 3.94 11.52 -26.8 2 2 1 26 297.447 3 ↓
Mid Mid (pH 6-8) 4.88 11.11 -7.38 1 2 0 24 296.439 2 ↓

Analogs

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Popular Name: (4R)-N-(4-ethoxyphenyl)-4-phenyl-4,5-dihydrothiazol-2-amine (4R)-N-(4-ethoxyphenyl)-4-phenyl…

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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 9.14 -29.55 2 3 1 35 299.419 5 ↓
Mid Mid (pH 6-8) 4.11 8.69 -8.13 1 3 0 34 298.411 4 ↓

Analogs

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Popular Name: (4S)-N-(4-ethoxyphenyl)-4-phenyl-4,5-dihydrothiazol-2-amine (4S)-N-(4-ethoxyphenyl)-4-phenyl…

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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 9.14 -29.35 2 3 1 35 299.419 5 ↓
Mid Mid (pH 6-8) 4.11 8.7 -7.94 1 3 0 34 298.411 4 ↓

Analogs

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Popular Name: (4R)-N-(2-methoxy-5-methyl-phenyl)-4-phenyl-4,5-dihydrothiazol-2-amine (4R)-N-(2-methoxy-5-methyl-pheny…

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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 8.85 -26.62 2 3 1 35 299.419 4 ↓
Mid Mid (pH 6-8) 4.11 8.57 -10.44 1 3 0 34 298.411 3 ↓

Analogs

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Popular Name: (4S)-N-(2-methoxy-5-methyl-phenyl)-4-phenyl-4,5-dihydrothiazol-2-amine (4S)-N-(2-methoxy-5-methyl-pheny…

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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 8.85 -26.59 2 3 1 35 299.419 4 ↓
Mid Mid (pH 6-8) 4.11 8.56 -10.4 1 3 0 34 298.411 3 ↓

Analogs

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Popular Name: N1,N1-dimethyl-N4-[(4R)-4-phenyl-4,5-dihydrothiazol-2-yl]benzene-1,4-diamine N1,N1-dimethyl-N4-[(4R)-4-phenyl…

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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 9.35 -27.29 2 3 1 29 298.435 4 ↓
Mid Mid (pH 6-8) 3.78 8.39 -6.19 1 3 0 28 297.427 4 ↓
Lo Low (pH 4.5-6) 3.78 10.09 -27.32 3 3 0 30 299.443 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N1,N1-dimethyl-N4-[(4S)-4-phenyl-4,5-dihydrothiazol-2-yl]benzene-1,4-diamine N1,N1-dimethyl-N4-[(4S)-4-phenyl…

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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 9.35 -27.25 2 3 1 29 298.435 4 ↓
Mid Mid (pH 6-8) 3.78 8.38 -6.34 1 3 0 28 297.427 4 ↓
Lo Low (pH 4.5-6) 3.78 10.09 -27.63 3 3 0 30 299.443 4 ↓

Analogs

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Popular Name: (4R)-N-(4-methoxy-3-methyl-phenyl)-4-phenyl-4,5-dihydrothiazol-2-amine (4R)-N-(4-methoxy-3-methyl-pheny…

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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 8.96 -29.44 2 3 1 35 299.419 4 ↓
Mid Mid (pH 6-8) 4.11 8.52 -8.47 1 3 0 34 298.411 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-N-(4-methoxy-3-methyl-phenyl)-4-phenyl-4,5-dihydrothiazol-2-amine (4S)-N-(4-methoxy-3-methyl-pheny…

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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 8.97 -29.6 2 3 1 35 299.419 4 ↓
Mid Mid (pH 6-8) 4.11 8.53 -8.22 1 3 0 34 298.411 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-N-(4-methoxy-2-methyl-phenyl)-4-phenyl-4,5-dihydrothiazol-2-amine (4R)-N-(4-methoxy-2-methyl-pheny…

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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 8.92 -30.26 2 3 1 35 299.419 4 ↓
Mid Mid (pH 6-8) 4.11 8.69 -8.08 1 3 0 34 298.411 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-N-(4-methoxy-2-methyl-phenyl)-4-phenyl-4,5-dihydrothiazol-2-amine (4S)-N-(4-methoxy-2-methyl-pheny…

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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 8.92 -30.25 2 3 1 35 299.419 4 ↓
Mid Mid (pH 6-8) 4.11 8.69 -8.17 1 3 0 34 298.411 3 ↓

Parameters Provided:

ring.id = 330835
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 = 330835 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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