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

37806029
37806029
37811111
37811111

Draw Identity 99% 90% 80% 70%

Popular Name: 1,4-benzenedicarboxamide, N,N'-bis(3-amino-3-oxopropyl)-N,N'-bis(phenylmethyl)- 1,4-benzenedicarboxamide, N,N'-b…

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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) 0.67 7.52 -24.64 4 8 0 127 486.572 12 ↓

Analogs

37797818
37797818
44869119
44869119
7871755
7871755

Draw Identity 99% 90% 80% 70%

Popular Name: N,N'-bis[(4-methoxyphenyl)methyl]-N,N'-dimethyl-terephthalamide N,N'-bis[(4-methoxyphenyl)methyl…

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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) 2.78 10.97 -19.59 0 6 0 59 432.52 8 ↓

Analogs

37008114
37008114
37008115
37008115
37032572
37032572
37032573
37032573
37032574
37032574

Draw Identity 99% 90% 80% 70%

Popular Name: N,N'-bis[(1S)-1-(3-fluoro-4-methoxy-phenyl)ethyl]terephthalamide N,N'-bis[(1S)-1-(3-fluoro-4-meth…

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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) 4.54 9.21 -28.83 2 6 0 77 468.5 8 ↓

Analogs

37008114
37008114
37008115
37008115
37032572
37032572
37032573
37032573
37032574
37032574

Draw Identity 99% 90% 80% 70%

Popular Name: N,N'-bis[(1R)-1-(3-fluoro-4-methoxy-phenyl)ethyl]terephthalamide N,N'-bis[(1R)-1-(3-fluoro-4-meth…

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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) 4.54 9.2 -20.5 2 6 0 77 468.5 8 ↓

Analogs

7945631
7945631

Draw Identity 99% 90% 80% 70%

Popular Name: N,N'-bis[[2-(dimethylaminomethyl)phenyl]methyl]terephthalamide N,N'-bis[[2-(dimethylaminomethyl…

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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) 2.63 14.83 -104.24 4 6 2 67 460.622 10 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N,N'-bis[(2-methoxy-5-methyl-phenyl)methyl]-N,N'-dimethyl-terephthalamide N,N'-bis[(2-methoxy-5-methyl-phe…

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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) 3.54 12.6 -13.67 0 6 0 59 460.574 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: methyl methyl

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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) 1.33 12.27 -19.5 2 8 0 111 488.54 12 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: methyl methyl

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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) 1.33 12.25 -19.67 2 8 0 111 488.54 12 ↓

Analogs

11510448
11510448
11512143
11512143

Draw Identity 99% 90% 80% 70%

Popular Name: N,N'-bis[[4-(difluoromethoxy)phenyl]methyl]terephthalamide N,N'-bis[[4-(difluoromethoxy)phe…

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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) 4.35 7.94 -16.28 2 6 0 77 476.426 10 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N1,N4-dibenzyl-2-nitro-terephthalamide N1,N4-dibenzyl-2-nitro-terephtha…

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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) 3.01 10.47 -21.4 2 7 0 104 389.411 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1,4-benzenedicarboxamide, N,N'-bis[(3-methoxy-4-propoxyphenyl)methyl]- 1,4-benzenedicarboxamide, N,N'-b…

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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) 4.17 10.61 -16.96 2 8 0 95 520.626 14 ↓

Parameters Provided:

ring.id = 23190
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 = 23190 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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