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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: 5-(1-naphthyl)pyridine-3-carboxylic 5-(1-naphthyl)pyridine-3-carboxylic

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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) 3.37 8.86 -47.27 0 3 -1 53 248.261 2 ↓
Lo Low (pH 4.5-6) 3.37 9.3 -41.25 1 3 0 54 249.269 2 ↓

Analogs

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Popular Name: 5-(4-methoxy-1-naphthyl)pyridine-3-carboxylic 5-(4-methoxy-1-naphthyl)pyridine…

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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) 3.38 8.21 -47.24 0 4 -1 62 278.287 3 ↓
Lo Low (pH 4.5-6) 3.38 8.65 -42.7 1 4 0 63 279.295 3 ↓

Analogs

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Popular Name: 5-(1-naphthyl)pyridin-2-amine 5-(1-naphthyl)pyridin-2-amine

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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) 3.65 7.05 -6.28 2 2 0 39 220.275 1 ↓
Mid Mid (pH 6-8) 3.65 7.59 -33.08 3 2 1 40 221.283 1 ↓

Analogs

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Popular Name: 5-(4-methoxy-1-naphthyl)pyridin-2-amine 5-(4-methoxy-1-naphthyl)pyridin-…

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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) 3.65 6.38 -7.24 2 3 0 48 250.301 2 ↓
Mid Mid (pH 6-8) 3.65 6.93 -35.28 3 3 1 49 251.309 2 ↓

Analogs

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Popular Name: YA-0615 YA-0615

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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) 3.75 6.75 -26.65 1 2 0 37 221.259 1 ↓
Hi High (pH 8-9.5) 3.75 6.22 -45.97 0 2 -1 36 220.251 1 ↓
Mid Mid (pH 6-8) 3.75 5.45 -6.68 1 2 0 33 221.259 1 ↓

Analogs

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Popular Name: YA-7656 YA-7656

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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) 3.32 8.69 -48.56 0 3 -1 53 248.261 2 ↓

Analogs

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Popular Name: YA-7660 YA-7660

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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 8.64 -57.3 0 3 -1 53 248.261 2 ↓
Lo Low (pH 4.5-6) 3.63 9.04 -39.3 1 3 0 54 249.269 2 ↓

Analogs

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Popular Name: YA-7664 YA-7664

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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) 3.15 7.91 -48.89 3 4 0 80 264.284 2 ↓
Mid Mid (pH 6-8) 3.15 7.44 -49.86 2 4 -1 79 263.276 2 ↓

Analogs

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Popular Name: YA-7665 YA-7665

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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) 3.15 8.3 -36.85 3 4 0 80 264.284 2 ↓
Mid Mid (pH 6-8) 3.15 7.85 -45.76 2 4 -1 79 263.276 2 ↓

Analogs

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Popular Name: YA-7666 YA-7666

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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) 3.44 5.64 -49.39 1 4 -1 73 264.26 2 ↓

Analogs

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Popular Name: YA-7669 YA-7669

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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) 3.72 8.14 -52.51 0 4 -1 62 278.287 3 ↓

Analogs

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Popular Name: YA-7670 YA-7670

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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) 4.34 9.19 -46.17 0 3 -1 53 282.706 2 ↓

Analogs

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Popular Name: YA-7671 YA-7671

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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) 4.34 9.12 -45.27 0 3 -1 53 282.706 2 ↓

Analogs

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Popular Name: YB-4011 YB-4011

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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) 3.46 7.8 -37.19 3 4 0 80 264.284 2 ↓
Mid Mid (pH 6-8) 3.46 7.38 -57.38 2 4 -1 79 263.276 2 ↓

Analogs

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Popular Name: 3-(1-naphthyl)pyridin-4-amine 3-(1-naphthyl)pyridin-4-amine

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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) 3.23 6.85 -32.1 3 2 1 40 221.283 1 ↓
Hi High (pH 8-9.5) 3.23 6.39 -5.52 2 2 0 39 220.275 1 ↓

Analogs

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Popular Name: 3-(1-naphthyl)pyridin-2-amine 3-(1-naphthyl)pyridin-2-amine

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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) 3.43 7.09 -5.36 2 2 0 39 220.275 1 ↓
Mid Mid (pH 6-8) 3.43 7.56 -31.34 3 2 1 40 221.283 1 ↓

Parameters Provided:

ring.id = 3588
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 = 3588 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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