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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: 4-(2-(2-Nitro-1H-imidazol-1-yl)ethyl)morpholine monohydrochloride; LS-93227; Morpholine, 4-(2-(2-nitro-1H-imidazol-1-yl)ethyl)-, monohydrochloride; SR 2514 4-(2-(2-Nitro-1H-imidazol-1-yl)e…

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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) 0.15 5.13 -13.24 0 7 0 76 226.236 4 ↓
Mid Mid (pH 6-8) 0.15 8 -105.62 2 7 2 79 228.252 4 ↓

Analogs

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Popular Name: [(2R)-4-[2-(2-methylimidazol-1-yl)ethyl]morpholin-2-yl]methanamine [(2R)-4-[2-(2-methylimidazol-1-y…

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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) -1.25 1.68 -81.18 4 5 2 59 226.324 4 ↓
Mid Mid (pH 6-8) -1.25 1.21 -48.13 3 5 1 58 225.316 4 ↓

Analogs

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Popular Name: [(2S)-4-[2-(2-methylimidazol-1-yl)ethyl]morpholin-2-yl]methanamine [(2S)-4-[2-(2-methylimidazol-1-y…

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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) -1.25 1.72 -80.22 4 5 2 59 226.324 4 ↓
Mid Mid (pH 6-8) -1.25 1.25 -47.59 3 5 1 58 225.316 4 ↓

Analogs

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Popular Name: 2-[1-[(1S)-1-methyl-2-morpholino-ethyl]imidazol-2-yl]sulfanylacetic 2-[1-[(1S)-1-methyl-2-morpholino…

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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) 0.40 5.14 -47.46 0 6 -1 70 284.361 6 ↓
Mid Mid (pH 6-8) 0.40 7.13 -69.2 1 6 0 72 285.369 6 ↓
Mid Mid (pH 6-8) 0.40 5.62 -44.18 1 6 0 72 285.369 6 ↓

Analogs

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Popular Name: 2-[1-[(1R)-1-methyl-2-morpholino-ethyl]imidazol-2-yl]sulfanylacetic 2-[1-[(1R)-1-methyl-2-morpholino…

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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) 0.40 5.15 -47.44 0 6 -1 70 284.361 6 ↓
Mid Mid (pH 6-8) 0.40 5.64 -44.16 1 6 0 72 285.369 6 ↓
Mid Mid (pH 6-8) 0.40 7.34 -63.36 1 6 0 72 285.369 6 ↓

Parameters Provided:

ring.id = 133515
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 = 133515 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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