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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: methyl methyl

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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) 1.28 6.81 -19.88 0 6 0 71 284.319 6 ↓
Lo Low (pH 4.5-6) 1.28 7.59 -43.08 1 6 1 72 285.327 6 ↓

Analogs

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Popular Name: 2-[cyclopropyl(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic 2-[cyclopropyl(imidazo[1,2-a]pyr…

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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) 0.04 8.42 -35.25 1 5 0 62 245.282 5 ↓

Analogs

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Popular Name: 2-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl-cyclopropyl-amino]acetic 2-[(6-chloroimidazo[1,2-a]pyridi…

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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) 0.67 8.93 -34.37 1 5 0 62 279.727 5 ↓

Analogs

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Popular Name: 2-[cyclopropyl-[(3-nitroimidazo[1,2-a]pyridin-2-yl)methyl]amino]acetic 2-[cyclopropyl-[(3-nitroimidazo[…

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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) 0.12 10.09 -32.23 1 8 0 108 290.279 6 ↓

Analogs

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Popular Name: 2-[cyclopropyl-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]acetic 2-[cyclopropyl-[(6-methylimidazo…

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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) 0.44 10.1 -72.11 2 5 1 63 260.317 5 ↓
Mid Mid (pH 6-8) 0.44 9.07 -34.5 1 5 0 62 259.309 5 ↓

Analogs

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Popular Name: 2-[cyclopropyl-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]acetic 2-[cyclopropyl-[(8-methylimidazo…

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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) 0.44 10.05 -71.65 2 5 1 63 260.317 5 ↓
Mid Mid (pH 6-8) 0.44 9.02 -34.97 1 5 0 62 259.309 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) 1.95 8.61 -27.69 1 5 1 48 274.344 7 ↓
Hi High (pH 8-9.5) 1.95 7.84 -15.79 0 5 0 47 273.336 7 ↓
Mid Mid (pH 6-8) 1.95 10.45 -98.53 2 5 2 49 275.352 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) 2.58 9.92 -40.24 1 5 1 48 308.789 7 ↓
Mid Mid (pH 6-8) 2.58 9.12 -29.01 1 5 1 48 308.789 7 ↓
Mid Mid (pH 6-8) 2.58 8.35 -12.76 0 5 0 47 307.781 7 ↓

Parameters Provided:

ring.id = 186653
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 = 186653 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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