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ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 4-[(2-chloro-7-methyl-3-quinolyl)methyleneaminoamino]benzoic 4-[(2-chloro-7-methyl-3-quinolyl…

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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) 6.05 9.81 -62.14 1 5 -1 77 338.774 4 ↓

Analogs

35461795
35461795

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Popular Name: 4-[(2-chloro-3-quinolyl)methyleneaminoamino]benzoic 4-[(2-chloro-3-quinolyl)methylen…

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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) 5.63 9.16 -61.94 1 5 -1 77 324.747 4 ↓

Analogs

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Popular Name: N-[(2-chloro-3-quinolyl)methyleneamino]-2-nitro-4-(trifluoromethyl)aniline N-[(2-chloro-3-quinolyl)methylen…

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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) 6.50 10.48 -11.1 1 6 0 83 394.74 5 ↓

Analogs

6344405
6344405

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Popular Name: 4-chloro-N-[(2-chloro-3-quinolyl)methyleneamino]aniline 4-chloro-N-[(2-chloro-3-quinolyl…

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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) 6.39 -0.78 -11.84 1 3 0 37 316.191 3 ↓

Analogs

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Popular Name: 4-chloro-N-[(2-chloro-7-methoxy-3-quinolyl)methyleneamino]aniline 4-chloro-N-[(2-chloro-7-methoxy-…

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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) 6.43 -0.75 -14.94 1 4 0 46 346.217 4 ↓

Parameters Provided:

ring.id = 1915
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 = 1915 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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