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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: (R)-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-(2-methylpyrazol-3-yl)methanol (R)-(1-methyl-3,4-dihydro-2H-qui…

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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) 2.13 5.04 -8.82 1 4 0 41 257.337 2 ↓
Lo Low (pH 4.5-6) 2.13 5.67 -39.13 2 4 1 42 258.345 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-(2-methylpyrazol-3-yl)methanol (S)-(1-methyl-3,4-dihydro-2H-qui…

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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) 2.13 4.97 -8.81 1 4 0 41 257.337 2 ↓
Lo Low (pH 4.5-6) 2.13 5.6 -39.49 2 4 1 42 258.345 2 ↓

Analogs

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Popular Name: (R)-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-(2-propylpyrazol-3-yl)methanol (R)-(1-methyl-3,4-dihydro-2H-qui…

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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) 3.01 6.47 -8.3 1 4 0 41 285.391 4 ↓
Lo Low (pH 4.5-6) 3.01 7.11 -39.15 2 4 1 42 286.399 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-(2-propylpyrazol-3-yl)methanol (S)-(1-methyl-3,4-dihydro-2H-qui…

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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) 3.01 6.61 -8.26 1 4 0 41 285.391 4 ↓
Lo Low (pH 4.5-6) 3.01 7.22 -39.28 2 4 1 42 286.399 4 ↓

Analogs

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Popular Name: (R)-(2-ethylpyrazol-3-yl)-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methanol (R)-(2-ethylpyrazol-3-yl)-(1-met…

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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) 2.51 5.72 -8.61 1 4 0 41 271.364 3 ↓
Lo Low (pH 4.5-6) 2.51 6.35 -39.19 2 4 1 42 272.372 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(2-ethylpyrazol-3-yl)-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methanol (S)-(2-ethylpyrazol-3-yl)-(1-met…

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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) 2.51 5.84 -8.58 1 4 0 41 271.364 3 ↓
Lo Low (pH 4.5-6) 2.51 6.46 -39.41 2 4 1 42 272.372 3 ↓

Analogs

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Popular Name: 6-[(2-methylpyrazol-3-yl)methyl]-1,2,3,4-tetrahydroquinoline 6-[(2-methylpyrazol-3-yl)methyl]…

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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) 2.93 6.4 -7.54 1 3 0 30 227.311 2 ↓
Lo Low (pH 4.5-6) 2.93 6.87 -41.39 2 3 1 34 228.319 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-[(2-propylpyrazol-3-yl)methyl]-1,2,3,4-tetrahydroquinoline 6-[(2-propylpyrazol-3-yl)methyl]…

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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) 3.81 8.02 -7.01 1 3 0 30 255.365 4 ↓
Lo Low (pH 4.5-6) 3.81 8.49 -41.2 2 3 1 34 256.373 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-[(2-ethylpyrazol-3-yl)methyl]-1,2,3,4-tetrahydroquinoline 6-[(2-ethylpyrazol-3-yl)methyl]-…

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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) 3.31 7.27 -7.3 1 3 0 30 241.338 3 ↓
Lo Low (pH 4.5-6) 3.31 7.74 -41.25 2 3 1 34 242.346 3 ↓

Parameters Provided:

ring.id = 342668
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 = 342668 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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