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

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[[(6R)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]methyl]indolizine-1-carbonitri 2-[[[(6R)-5,6,7,8-tetrahydro-[1,…

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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) 0.75 9.46 -59.54 2 6 1 76 293.354 3 ↓
Hi High (pH 8-9.5) 0.75 8.3 -15.49 1 6 0 71 292.346 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[[(6S)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]methyl]indolizine-1-carbonitri 2-[[[(6S)-5,6,7,8-tetrahydro-[1,…

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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) 0.75 9.46 -56.49 2 6 1 76 293.354 3 ↓
Hi High (pH 8-9.5) 0.75 8.28 -13.27 1 6 0 71 292.346 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[[(6R)-2-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]methyl]indolizine-1-ca 2-[[[(6R)-2-ethyl-5,6,7,8-tetrah…

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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) 1.41 9.96 -59.77 2 6 1 76 321.408 4 ↓
Hi High (pH 8-9.5) 1.41 8.78 -18.98 1 6 0 71 320.4 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[[(6S)-2-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]methyl]indolizine-1-ca 2-[[[(6S)-2-ethyl-5,6,7,8-tetrah…

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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) 1.41 9.96 -56.61 2 6 1 76 321.408 4 ↓
Hi High (pH 8-9.5) 1.41 8.8 -15.48 1 6 0 71 320.4 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[[(6R)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]methyl]indolizine-1-c 2-[[[(6R)-2-methyl-5,6,7,8-tetra…

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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) 0.84 9.35 -60.02 2 6 1 76 307.381 3 ↓
Hi High (pH 8-9.5) 0.84 8.17 -19.15 1 6 0 71 306.373 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[[(6S)-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]methyl]indolizine-1-c 2-[[[(6S)-2-methyl-5,6,7,8-tetra…

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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) 0.84 9.35 -56.89 2 6 1 76 307.381 3 ↓
Hi High (pH 8-9.5) 0.84 8.19 -15.62 1 6 0 71 306.373 3 ↓

Parameters Provided:

ring.id = 385809
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 = 385809 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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