UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: N-(3-butoxyphenyl)-N'-[2-(1H-indol-3-yl)ethyl]oxamide N-(3-butoxyphenyl)-N'-[2-(1H-ind…

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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) 3.65 7.5 -12.3 3 6 0 83 379.46 9 ↓

Analogs

10326993
10326993

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Popular Name: N'-[4-(difluoromethoxy)phenyl]-N-[2-(1H-indol-3-yl)ethyl]oxamide N'-[4-(difluoromethoxy)phenyl]-N…

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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) 2.79 5.28 -12.01 3 6 0 83 373.359 7 ↓

Analogs

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Popular Name: N'-[4-(cyanomethyl)phenyl]-N-[2-(1H-indol-3-yl)ethyl]oxamide N'-[4-(cyanomethyl)phenyl]-N-[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) 2.14 6.88 -16.19 3 6 0 98 346.39 6 ↓

Analogs

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Popular Name: N'-(4-cyanophenyl)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]oxamide N'-(4-cyanophenyl)-N-[2-(2-methy…

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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) 2.15 6.59 -12.01 3 6 0 98 346.39 5 ↓
Hi High (pH 8-9.5) 2.34 5.79 -44.21 2 6 -1 104 345.382 5 ↓

Analogs

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Popular Name: N'-[3-[isopropyl(methyl)amino]phenyl]-N-[2-(4-methyl-1H-indol-3-yl)ethyl]oxamide N'-[3-[isopropyl(methyl)amino]ph…

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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) 3.33 7.88 -10.49 3 6 0 77 392.503 7 ↓
Lo Low (pH 4.5-6) 3.33 8.31 -28.84 4 6 0 78 393.511 7 ↓

Analogs

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Popular Name: N'-(2-fluorophenyl)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]oxamide N'-(2-fluorophenyl)-N-[2-(2-meth…

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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) 2.51 6.3 -10.32 3 5 0 74 339.37 5 ↓

Parameters Provided:

ring.id = 136524
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 = 136524 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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