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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-piperazineacetic acid, 3-oxo-1-(1-piperidinylacetyl)-, propyl ester 2-piperazineacetic acid, 3-oxo-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) 0.26 6.56 -48.25 2 7 1 80 326.417 7 ↓
Hi High (pH 8-9.5) 0.26 4.39 -14.1 1 7 0 79 325.409 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-piperazineacetic acid, 3-oxo-1-(1-piperidinylacetyl)-, propyl ester 2-piperazineacetic acid, 3-oxo-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) 0.26 6.93 -47.66 2 7 1 80 326.417 7 ↓
Hi High (pH 8-9.5) 0.26 4.81 -17.43 1 7 0 79 325.409 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-piperazineacetic acid, 3-oxo-1-(1-piperidinylacetyl)-, butyl ester 2-piperazineacetic acid, 3-oxo-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) 0.82 7.34 -48.22 2 7 1 80 340.444 8 ↓
Hi High (pH 8-9.5) 0.82 5.17 -13.96 1 7 0 79 339.436 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-piperazineacetic acid, 3-oxo-1-(1-piperidinylacetyl)-, butyl ester 2-piperazineacetic acid, 3-oxo-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) 0.82 7.71 -47.74 2 7 1 80 340.444 8 ↓
Hi High (pH 8-9.5) 0.82 5.6 -17.37 1 7 0 79 339.436 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-piperazineacetic acid, 3-oxo-1-(1-piperidinylacetyl)-, 2-methylpropyl ester 2-piperazineacetic acid, 3-oxo-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) 0.50 7.22 -48.06 2 7 1 80 340.444 7 ↓
Hi High (pH 8-9.5) 0.50 5.05 -13.88 1 7 0 79 339.436 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-piperazineacetic acid, 3-oxo-1-(1-piperidinylacetyl)-, 2-methylpropyl ester 2-piperazineacetic acid, 3-oxo-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) 0.50 7.6 -47.57 2 7 1 80 340.444 7 ↓
Hi High (pH 8-9.5) 0.50 5.47 -17.29 1 7 0 79 339.436 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-piperazineacetic acid, 1-[(4-methyl-1-piperidinyl)acetyl]-3-oxo-, propyl ester 2-piperazineacetic acid, 1-[(4-m…

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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) 0.50 7.17 -49.2 2 7 1 80 340.444 7 ↓
Hi High (pH 8-9.5) 0.50 4.99 -13.88 1 7 0 79 339.436 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-piperazineacetic acid, 1-[(4-methyl-1-piperidinyl)acetyl]-3-oxo-, propyl ester 2-piperazineacetic acid, 1-[(4-m…

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) 0.50 7.55 -48.59 2 7 1 80 340.444 7 ↓
Hi High (pH 8-9.5) 0.50 5.41 -17.38 1 7 0 79 339.436 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-piperazineacetic acid, 1-[(4-methyl-1-piperidinyl)acetyl]-3-oxo-, butyl ester 2-piperazineacetic acid, 1-[(4-m…

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) 1.06 7.95 -49.23 2 7 1 80 354.471 8 ↓
Hi High (pH 8-9.5) 1.06 5.77 -13.74 1 7 0 79 353.463 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-piperazineacetic acid, 1-[(4-methyl-1-piperidinyl)acetyl]-3-oxo-, butyl ester 2-piperazineacetic acid, 1-[(4-m…

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) 1.06 8.34 -48.58 2 7 1 80 354.471 8 ↓
Hi High (pH 8-9.5) 1.06 6.19 -17.28 1 7 0 79 353.463 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-piperazineacetic acid, 1-[(4-methyl-1-piperidinyl)acetyl]-3-oxo-, 2-methylpropyl ester 2-piperazineacetic acid, 1-[(4-m…

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) 0.74 8.2 -48.48 2 7 1 80 354.471 7 ↓
Hi High (pH 8-9.5) 0.74 6.06 -17.2 1 7 0 79 353.463 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-piperazineacetic acid, 1-[(4-methyl-1-piperidinyl)acetyl]-3-oxo-, 2-methylpropyl ester 2-piperazineacetic acid, 1-[(4-m…

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) 0.74 7.87 -47.01 2 7 1 80 354.471 7 ↓
Hi High (pH 8-9.5) 0.74 5.69 -12.91 1 7 0 79 353.463 7 ↓

Parameters Provided:

ring.id = 495997
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 = 495997 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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