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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-[(2R)-2-(dimethylamino)-3-phenyl-propyl]-2-[(5S,7R)-7,9,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]d N-[(2R)-2-(dimethylamino)-3-phen…

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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) 3.24 10.67 -45.16 3 7 1 83 429.585 7 ↓
Hi High (pH 8-9.5) 3.24 7.66 -12.83 2 7 0 82 428.577 7 ↓

Analogs

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Popular Name: N-[(2R)-2-(dimethylamino)-3-phenyl-propyl]-2-[(5S,7S)-7,9,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]d N-[(2R)-2-(dimethylamino)-3-phen…

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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) 3.24 9.93 -44.94 3 7 1 83 429.585 7 ↓
Hi High (pH 8-9.5) 3.24 6.95 -13.24 2 7 0 82 428.577 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2R)-2-(dimethylamino)-3-phenyl-propyl]-2-[(5R,7R)-7,9,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]d N-[(2R)-2-(dimethylamino)-3-phen…

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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) 3.24 9.94 -45.4 3 7 1 83 429.585 7 ↓
Hi High (pH 8-9.5) 3.24 6.97 -13.78 2 7 0 82 428.577 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2R)-2-(dimethylamino)-3-phenyl-propyl]-2-[(5R,7S)-7,9,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]d N-[(2R)-2-(dimethylamino)-3-phen…

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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) 3.24 10.65 -45.13 3 7 1 83 429.585 7 ↓
Hi High (pH 8-9.5) 3.24 7.67 -12.73 2 7 0 82 428.577 7 ↓

Analogs

42671822
42671822
42671823
42671823
42671895
42671895
42671896
42671896

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Popular Name: N-[(2S)-2-(diethylamino)-3-phenyl-propyl]-2-(4-methyl-1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl)acetam N-[(2S)-2-(diethylamino)-3-pheny…

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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) 3.58 10.36 -41.56 2 7 1 74 429.585 9 ↓
Hi High (pH 8-9.5) 3.58 9.26 -13.28 1 7 0 73 428.577 9 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2R)-2-(diethylamino)-3-phenyl-propyl]-2-(4-methyl-1,3-dioxo-2,4-diazaspiro[4.5]decan-2-yl)acetam N-[(2R)-2-(diethylamino)-3-pheny…

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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) 3.58 11.38 -43.11 2 7 1 74 429.585 9 ↓
Hi High (pH 8-9.5) 3.58 9.55 -13.12 1 7 0 73 428.577 9 ↓

Parameters Provided:

ring.id = 203642
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 = 203642 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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