UCSF
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Analogs

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Popular Name: 4,6-dimethoxy-N-(1-methyl-4-piperidyl)-1,3,5-triazin-2-amine 4,6-dimethoxy-N-(1-methyl-4-pipe…

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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) 1.88 1.46 -41.11 2 7 1 74 254.314 4 ↓

Analogs

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Popular Name: 2-[4-[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]-1-piperidyl]acetamide 2-[4-[(4,6-dimethoxy-1,3,5-triaz…

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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) 0.62 -1.65 -44.94 4 9 1 117 297.339 6 ↓
Mid Mid (pH 6-8) 0.62 -3.86 -12.4 3 9 0 116 296.331 6 ↓

Analogs

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Popular Name: N-(1-ethyl-4-piperidyl)-4,6-dimethoxy-1,3,5-triazin-2-amine N-(1-ethyl-4-piperidyl)-4,6-dime…

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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) 2.26 2.12 -39.74 2 7 1 74 268.341 5 ↓

Analogs

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Popular Name: 4,6-dimethoxy-N-(1-propyl-4-piperidyl)-1,3,5-triazin-2-amine 4,6-dimethoxy-N-(1-propyl-4-pipe…

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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) 2.76 2.87 -40.48 2 7 1 74 282.368 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4,6-dimethoxy-N-(4-piperidyl)-1,3,5-triazin-2-amine 4,6-dimethoxy-N-(4-piperidyl)-1,…

Find On: PubMed — Wikipedia — Google

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) 1.29 -0.76 -45.94 3 7 1 86 240.287 4 ↓

Parameters Provided:

ring.id = 217070
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 = 217070 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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