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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: (1R,3R)-3-(phenoxymethyl)-1'-[[2-(trifluoromethyl)phenyl]methyl]spiro[4,5,6,7-tetrahydro-3H-cyclopen (1R,3R)-3-(phenoxymethyl)-1'-[[2…

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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) 6.30 15.88 -14.87 0 4 0 39 505.536 6 ↓

Analogs

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Popular Name: (1S,3S)-3-(phenoxymethyl)-1'-[[2-(trifluoromethyl)phenyl]methyl]spiro[4,5,6,7-tetrahydro-3H-cyclopen (1S,3S)-3-(phenoxymethyl)-1'-[[2…

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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) 6.30 15.98 -14.03 0 4 0 39 505.536 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,3R)-3-(phenoxymethyl)-1'-[[2-(trifluoromethyl)phenyl]methyl]spiro[4,5,6,7-tetrahydro-3H-cyclopen (1S,3R)-3-(phenoxymethyl)-1'-[[2…

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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) 6.30 16.18 -13.49 0 4 0 39 505.536 6 ↓

Analogs

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Popular Name: (1R,3R)-1'-(3-methylbut-2-enyl)-3-(phenoxymethyl)spiro[4,5,6,7-tetrahydro-3H-cyclopenta[c]pyran-1,3' (1R,3R)-1'-(3-methylbut-2-enyl)-…

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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) 5.73 13.66 -15.28 0 4 0 39 415.533 5 ↓

Analogs

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Popular Name: (1S,3R)-1'-(3-methylbut-2-enyl)-3-(phenoxymethyl)spiro[4,5,6,7-tetrahydro-3H-cyclopenta[c]pyran-1,3' (1S,3R)-1'-(3-methylbut-2-enyl)-…

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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) 5.73 13.83 -14.38 0 4 0 39 415.533 5 ↓

Analogs

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Popular Name: (1S,3S)-1'-(3-methylbut-2-enyl)-3-(phenoxymethyl)spiro[4,5,6,7-tetrahydro-3H-cyclopenta[c]pyran-1,3' (1S,3S)-1'-(3-methylbut-2-enyl)-…

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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) 5.73 13.66 -14.57 0 4 0 39 415.533 5 ↓

Analogs

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Popular Name: ethyl ethyl

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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) 4.29 13 -19.63 0 6 0 65 433.504 7 ↓

Analogs

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Popular Name: ethyl ethyl

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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) 4.29 13.17 -17.06 0 6 0 65 433.504 7 ↓

Analogs

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Popular Name: ethyl ethyl

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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) 4.29 13.01 -17.67 0 6 0 65 433.504 7 ↓

Parameters Provided:

ring.id = 471767
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 = 471767 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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