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

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,3R)-3-(2-pyridyl)cyclopentanamine (1S,3R)-3-(2-pyridyl)cyclopentan…

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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) 0.27 3.12 -48.63 3 2 1 41 163.244 1 ↓
Lo Low (pH 4.5-6) 0.27 3.54 -91.45 4 2 2 42 164.252 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,3S)-3-(2-pyridyl)cyclopentanamine (1S,3S)-3-(2-pyridyl)cyclopentan…

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Activity (Go SEA)

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) 0.27 3.13 -46.84 3 2 1 41 163.244 1 ↓
Lo Low (pH 4.5-6) 0.27 3.81 -91.78 4 2 2 42 164.252 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,3R)-3-(2-pyridyl)cyclopentanamine (1R,3R)-3-(2-pyridyl)cyclopentan…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.27 3.09 -48.2 3 2 1 41 163.244 1 ↓
Lo Low (pH 4.5-6) 0.27 3.51 -91 4 2 2 42 164.252 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,3S)-3-(2-pyridyl)cyclopentanamine (1R,3S)-3-(2-pyridyl)cyclopentan…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.27 3.09 -48.27 3 2 1 41 163.244 1 ↓
Lo Low (pH 4.5-6) 0.27 3.5 -91.14 4 2 2 42 164.252 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,3R)-3-(2-pyridyl)cyclopentanol (1S,3R)-3-(2-pyridyl)cyclopentanol

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.76 2.51 -5.18 1 2 0 33 163.22 1 ↓
Lo Low (pH 4.5-6) 0.76 2.92 -30.73 2 2 1 34 164.228 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,3S)-3-(2-pyridyl)cyclopentanol (1S,3S)-3-(2-pyridyl)cyclopentanol

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.76 2.5 -6.17 1 2 0 33 163.22 1 ↓
Lo Low (pH 4.5-6) 0.76 3.18 -30.73 2 2 1 34 164.228 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,3R)-3-(2-pyridyl)cyclopentanol (1R,3R)-3-(2-pyridyl)cyclopentanol

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.76 2.46 -5.71 1 2 0 33 163.22 1 ↓
Lo Low (pH 4.5-6) 0.76 2.88 -31.16 2 2 1 34 164.228 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,3S)-3-(2-pyridyl)cyclopentanol (1R,3S)-3-(2-pyridyl)cyclopentanol

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.76 2.5 -5.26 1 2 0 33 163.22 1 ↓
Lo Low (pH 4.5-6) 0.76 3.18 -28.16 2 2 1 34 164.228 1 ↓

Parameters Provided:

ring.id = 25427
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 = 25427 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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