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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

14234680
14234680
21558986
21558986
21558988
21558988
21558991
21558991
21558994
21558994

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Popular Name: 2-[(2S)-2-hydroxy-3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]propyl]-2,4-diazaspiro[4.6]undecane-1,3-di 2-[(2S)-2-hydroxy-3-[2-methoxy-4…

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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) 3.39 7.01 -13.22 2 7 0 88 402.491 7 ↓

Analogs

21558986
21558986
21558988
21558988
21558991
21558991
21558994
21558994
14234675
14234675

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2R)-2-hydroxy-3-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]propyl]-2,4-diazaspiro[4.6]undecane-1,3-di 2-[(2R)-2-hydroxy-3-[2-methoxy-4…

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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) 3.39 6.55 -13.38 2 7 0 88 402.491 7 ↓

Analogs

14253969
14253969

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Popular Name: 2-[(2R)-3-(2,4-dichlorophenoxy)-2-hydroxy-propyl]-2,4-diazaspiro[4.6]undecane-1,3-dione 2-[(2R)-3-(2,4-dichlorophenoxy)-…

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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) 3.98 6.01 -11.25 2 6 0 79 401.29 5 ↓

Analogs

14253966
14253966

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2S)-3-(2,4-dichlorophenoxy)-2-hydroxy-propyl]-2,4-diazaspiro[4.6]undecane-1,3-dione 2-[(2S)-3-(2,4-dichlorophenoxy)-…

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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) 3.98 6.16 -10.95 2 6 0 79 401.29 5 ↓

Parameters Provided:

ring.id = 234826
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 = 234826 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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