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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 2-(4-benzylpiperidino)-N-isopropyl-5-(phenylcarbamoylamino)benzamide 2-(4-benzylpiperidino)-N-isoprop…

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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) 5.62 12.45 -20.57 3 6 0 73 470.617 7 ↓

Analogs

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Popular Name: 2-(4-benzylpiperidino)-5-[(2,4-dimethoxyphenyl)carbamoylamino]-N-isopropyl-benzamide 2-(4-benzylpiperidino)-5-[(2,4-d…

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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) 5.66 11.21 -19.79 3 8 0 92 530.669 9 ↓

Analogs

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Popular Name: 2-(4-benzylpiperidino)-N-isopropyl-5-[(2-methoxyphenyl)carbamoylamino]benzamide 2-(4-benzylpiperidino)-N-isoprop…

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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 11.93 -18.77 3 7 0 83 500.643 8 ↓

Analogs

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Popular Name: 2-(4-benzylpiperidino)-N-isopropyl-5-[(3-methoxyphenyl)carbamoylamino]benzamide 2-(4-benzylpiperidino)-N-isoprop…

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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) 5.65 -2.2 -18.14 3 7 0 82 500.643 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4-benzylpiperidino)-N-isopropyl-5-[(4-methoxyphenyl)carbamoylamino]benzamide 2-(4-benzylpiperidino)-N-isoprop…

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) 5.67 11.75 -21.6 3 7 0 83 500.643 8 ↓

Analogs

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Popular Name: 2-(4-benzyl-1-piperidyl)-5-[(4-ethoxyphenyl)carbamoylamino]-N-isopropyl-benzamide 2-(4-benzyl-1-piperidyl)-5-[(4-e…

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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 12.67 -21.4 3 7 0 83 514.67 9 ↓

Parameters Provided:

ring.id = 696
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 = 696 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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