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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: N-[(1R)-indan-1-yl]-1-methyl-piperidin-4-amine N-[(1R)-indan-1-yl]-1-methyl-pip…

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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 8.7 -108.1 3 2 2 21 232.371 2 ↓
Mid Mid (pH 6-8) 2.36 6.28 -38.87 2 2 1 20 231.363 2 ↓

Analogs

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Popular Name: N-[(1S)-indan-1-yl]-1-methyl-piperidin-4-amine N-[(1S)-indan-1-yl]-1-methyl-pip…

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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 8.54 -106.13 3 2 2 21 232.371 2 ↓
Mid Mid (pH 6-8) 2.36 6.12 -38.2 2 2 1 20 231.363 2 ↓

Analogs

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Popular Name: N-[(1R)-indan-1-yl]-1-isopropyl-piperidin-4-amine N-[(1R)-indan-1-yl]-1-isopropyl-…

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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) 3.04 9.72 -108.76 3 2 2 21 260.425 3 ↓
Mid Mid (pH 6-8) 3.04 7.46 -38.64 2 2 1 20 259.417 3 ↓

Analogs

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Popular Name: N-[(1S)-indan-1-yl]-1-isopropyl-piperidin-4-amine N-[(1S)-indan-1-yl]-1-isopropyl-…

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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) 3.04 9.51 -106.66 3 2 2 21 260.425 3 ↓
Mid Mid (pH 6-8) 3.04 7.25 -37.93 2 2 1 20 259.417 3 ↓

Analogs

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Popular Name: 1-ethyl-N-[(1R)-indan-1-yl]piperidin-4-amine 1-ethyl-N-[(1R)-indan-1-yl]piper…

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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) 2.74 9.37 -108.37 3 2 2 21 246.398 3 ↓
Mid Mid (pH 6-8) 2.74 7.08 -38.81 2 2 1 20 245.39 3 ↓

Analogs

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Popular Name: 1-ethyl-N-[(1S)-indan-1-yl]piperidin-4-amine 1-ethyl-N-[(1S)-indan-1-yl]piper…

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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) 2.74 9.13 -106.36 3 2 2 21 246.398 3 ↓
Mid Mid (pH 6-8) 2.74 6.78 -38.17 2 2 1 20 245.39 3 ↓

Analogs

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Popular Name: N-[(1R)-indan-1-yl]-1-prop-2-ynyl-piperidin-4-amine N-[(1R)-indan-1-yl]-1-prop-2-yny…

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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) 2.52 7.37 -38.92 2 2 1 20 255.385 3 ↓

Analogs

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Popular Name: N-[(1S)-indan-1-yl]-1-prop-2-ynyl-piperidin-4-amine N-[(1S)-indan-1-yl]-1-prop-2-yny…

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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) 2.52 7.28 -40.53 2 2 1 20 255.385 3 ↓

Analogs

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Popular Name: N-[(1R)-indan-1-yl]-1-(3-methylbut-2-enyl)piperidin-4-amine N-[(1R)-indan-1-yl]-1-(3-methylb…

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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 8.84 -36.96 2 2 1 20 285.455 4 ↓
Lo Low (pH 4.5-6) 4.04 11.09 -108.63 3 2 2 21 286.463 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-indan-1-yl]-1-(3-methylbut-2-enyl)piperidin-4-amine N-[(1S)-indan-1-yl]-1-(3-methylb…

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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 8.75 -38.62 2 2 1 20 285.455 4 ↓
Lo Low (pH 4.5-6) 4.04 11 -110.33 3 2 2 21 286.463 4 ↓

Analogs

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Popular Name: 4-[[(1S)-indan-1-yl]amino]piperidine-1-carboxamide 4-[[(1S)-indan-1-yl]amino]piperi…

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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) 1.64 4.76 -47.41 4 4 1 63 260.361 2 ↓

Analogs

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Popular Name: 4-[[(1R)-indan-1-yl]amino]piperidine-1-carboxamide 4-[[(1R)-indan-1-yl]amino]piperi…

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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) 1.64 4.96 -50.11 4 4 1 63 260.361 2 ↓

Analogs

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Popular Name: N-[(1S)-indan-1-yl]-1-(2,2,2-trifluoroethyl)piperidin-4-amine N-[(1S)-indan-1-yl]-1-(2,2,2-tri…

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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) 3.29 7.31 -39.94 2 2 1 20 299.36 4 ↓

Analogs

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Popular Name: N-[(1R)-indan-1-yl]-1-(2,2,2-trifluoroethyl)piperidin-4-amine N-[(1R)-indan-1-yl]-1-(2,2,2-tri…

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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) 3.29 7.48 -41.62 2 2 1 20 299.36 4 ↓

Parameters Provided:

ring.id = 25898
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 = 25898 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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