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

Analogs

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Popular Name: 1-[2-[[(3R)-3-amino-2,3-dihydrobenzofuran-6-yl]oxy]ethyl]imidazolidin-2-one 1-[2-[[(3R)-3-amino-2,3-dihydrob…

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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) -1.48 0.59 -53.47 4 6 1 78 264.305 4 ↓
Hi High (pH 8-9.5) -1.48 0.3 -12.64 3 6 0 77 263.297 4 ↓

Analogs

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Popular Name: 1-[2-[[(3S)-3-amino-2,3-dihydrobenzofuran-6-yl]oxy]ethyl]imidazolidin-2-one 1-[2-[[(3S)-3-amino-2,3-dihydrob…

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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) -1.48 0.61 -56.57 4 6 1 78 264.305 4 ↓
Hi High (pH 8-9.5) -1.48 0.3 -11.81 3 6 0 77 263.297 4 ↓

Analogs

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Popular Name: 1-[2-[[(3S)-3-(methylamino)-2,3-dihydrobenzofuran-6-yl]oxy]ethyl]imidazolidin-2-one 1-[2-[[(3S)-3-(methylamino)-2,3-…

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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) 0.78 2.33 -48.19 3 6 1 67 278.332 5 ↓
Hi High (pH 8-9.5) 0.78 1.09 -11.66 2 6 0 63 277.324 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[2-[[(3R)-3-(methylamino)-2,3-dihydrobenzofuran-6-yl]oxy]ethyl]imidazolidin-2-one 1-[2-[[(3R)-3-(methylamino)-2,3-…

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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) 0.78 2.33 -47.71 3 6 1 67 278.332 5 ↓
Hi High (pH 8-9.5) 0.78 1.1 -11.59 2 6 0 63 277.324 5 ↓

Analogs

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Popular Name: 1-[2-[[(3S)-3-(ethylamino)-2,3-dihydrobenzofuran-6-yl]oxy]ethyl]imidazolidin-2-one 1-[2-[[(3S)-3-(ethylamino)-2,3-d…

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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) 1.15 3.17 -46.92 3 6 1 67 292.359 6 ↓
Hi High (pH 8-9.5) 1.15 2 -11.44 2 6 0 63 291.351 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[2-[[(3R)-3-(ethylamino)-2,3-dihydrobenzofuran-6-yl]oxy]ethyl]imidazolidin-2-one 1-[2-[[(3R)-3-(ethylamino)-2,3-d…

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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) 1.15 3.17 -46.54 3 6 1 67 292.359 6 ↓
Hi High (pH 8-9.5) 1.15 2.02 -11.43 2 6 0 63 291.351 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[2-[[(3R)-3-hydroxy-2,3-dihydrobenzofuran-6-yl]oxy]ethyl]imidazolidin-2-one 1-[2-[[(3R)-3-hydroxy-2,3-dihydr…

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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) 0.22 -0.04 -14.7 2 6 0 71 264.281 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[2-[[(3S)-3-hydroxy-2,3-dihydrobenzofuran-6-yl]oxy]ethyl]imidazolidin-2-one 1-[2-[[(3S)-3-hydroxy-2,3-dihydr…

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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) 0.22 -0.04 -13.66 2 6 0 71 264.281 4 ↓

Parameters Provided:

ring.id = 275154
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 = 275154 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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