UCSF
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Analogs

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Popular Name: 7-chloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-ol 7-chloro-2,3-dihydro-1H-cyclopen…

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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) 2.18 6.67 -15.36 1 2 0 33 219.671 0 ↓

Analogs

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Popular Name: 7-(1-piperidyl)-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one 7-(1-piperidyl)-1,2,3,4-tetrahyd…

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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 8.53 -16.65 1 3 0 36 268.36 1 ↓

Analogs

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Popular Name: 7-pyrrolidin-1-yl-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one 7-pyrrolidin-1-yl-1,2,3,4-tetrah…

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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) 2.01 7.87 -17.61 1 3 0 36 254.333 1 ↓

Analogs

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Popular Name: 7-(diethylamino)-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one 7-(diethylamino)-1,2,3,4-tetrahy…

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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 8.45 -16.53 1 3 0 36 256.349 3 ↓
Lo Low (pH 4.5-6) 2.36 8.56 -37.36 2 3 0 37 257.357 3 ↓

Analogs

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Popular Name: 7-morpholino-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one 7-morpholino-1,2,3,4-tetrahydroc…

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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) 1.45 6.11 -17.61 1 4 0 45 270.332 1 ↓

Analogs

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Popular Name: 5-(methoxymethyl)-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one 5-(methoxymethyl)-1,2,3,4-tetrah…

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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) 1.44 6.12 -14.38 1 3 0 42 229.279 2 ↓

Analogs

42400861
42400861

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Popular Name: 5-propyl-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one 5-propyl-1,2,3,4-tetrahydrocyclo…

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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) 2.79 8.44 -14.01 1 2 0 33 227.307 2 ↓

Analogs

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Popular Name: 8-bromo-5-methoxy-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one 8-bromo-5-methoxy-1,2,3,4-tetrah…

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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) 3.14 6.2 -13.14 1 3 0 42 294.148 1 ↓

Analogs

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Popular Name: 7-fluoro-5-methoxy-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one 7-fluoro-5-methoxy-1,2,3,4-tetra…

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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) 0.68 5.64 -12.87 1 3 0 42 233.242 1 ↓

Parameters Provided:

ring.id = 44612
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 = 44612 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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