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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

9578765
9578765

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-[6-(3-pyridylmethylamino)-[1,2,4]triazolo[3,4-f]pyridazin-3-yl]ethyl]benzenesulfonamide N-[2-[6-(3-pyridylmethylamino)-[…

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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) 1.38 5.8 -20.13 2 9 0 114 409.475 8 ↓
Lo Low (pH 4.5-6) 1.38 6.27 -53.75 3 9 1 115 410.483 8 ↓

Analogs

9578765
9578765
9578764
9578764

Draw Identity 99% 90% 80% 70%

Popular Name: 4-fluoro-N-[2-[6-(3-pyridylmethylamino)-[1,2,4]triazolo[3,4-f]pyridazin-3-yl]ethyl]benzenesulfonamid 4-fluoro-N-[2-[6-(3-pyridylmethy…

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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) 1.54 5.87 -20.04 2 9 0 114 427.465 8 ↓
Lo Low (pH 4.5-6) 1.54 6.34 -57.33 3 9 1 115 428.473 8 ↓

Analogs

9578765
9578765
9578764
9578764

Draw Identity 99% 90% 80% 70%

Popular Name: 3-methyl-N-[2-[6-(3-pyridylmethylamino)-[1,2,4]triazolo[3,4-f]pyridazin-3-yl]ethyl]benzenesulfonamid 3-methyl-N-[2-[6-(3-pyridylmethy…

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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) 1.80 6.48 -20.09 2 9 0 114 423.502 8 ↓
Lo Low (pH 4.5-6) 1.80 6.95 -53.64 3 9 1 115 424.51 8 ↓

Analogs

9578765
9578765

Draw Identity 99% 90% 80% 70%

Popular Name: 2-methoxy-N-[2-[6-(3-pyridylmethylamino)-[1,2,4]triazolo[3,4-f]pyridazin-3-yl]ethyl]benzenesulfonami 2-methoxy-N-[2-[6-(3-pyridylmeth…

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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) 1.39 5.62 -20.9 2 10 0 123 439.501 9 ↓
Lo Low (pH 4.5-6) 1.39 6.09 -53.7 3 10 1 125 440.509 9 ↓

Analogs

9578765
9578765

Draw Identity 99% 90% 80% 70%

Popular Name: 4-methyl-N-[2-[6-(3-pyridylmethylamino)-[1,2,4]triazolo[3,4-f]pyridazin-3-yl]ethyl]benzenesulfonamid 4-methyl-N-[2-[6-(3-pyridylmethy…

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Activity (Go SEA)

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) 1.83 6.49 -20 2 9 0 114 423.502 8 ↓
Lo Low (pH 4.5-6) 1.83 6.96 -53.6 3 9 1 115 424.51 8 ↓

Parameters Provided:

ring.id = 102753
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 = 102753 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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