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

34921841
34921841

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Popular Name: 3-(methanesulfonamido)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide 3-(methanesulfonamido)-N-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) 1.97 8.05 -20.65 0 6 0 72 386.497 6 ↓
Lo Low (pH 4.5-6) 1.97 8.01 -15.7 1 6 0 70 387.505 6 ↓

Analogs

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Popular Name: N-methyl-3-(methylsulfamoyl)-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide N-methyl-3-(methylsulfamoyl)-N-[…

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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) 1.80 7.38 -19.31 1 6 0 70 387.505 6 ↓

Analogs

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Popular Name: 2,3,4-trimethoxy-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide 2,3,4-trimethoxy-N-methyl-N-[(2-…

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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) 3.14 10.61 -11.97 0 6 0 51 384.476 7 ↓

Analogs

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Popular Name: 2,4-difluoro-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide 2,4-difluoro-N-methyl-N-[(2-pyrr…

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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) 3.02 11.41 -12.63 0 3 0 24 330.378 4 ↓

Analogs

39678248
39678248
39678249
39678249

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Popular Name: 3,4-dimethoxy-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide 3,4-dimethoxy-N-methyl-N-[(2-pyr…

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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) 2.41 10.5 -13.2 0 5 0 42 354.45 6 ↓

Analogs

39678352
39678352
39678353
39678353

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Popular Name: 2,3-dimethoxy-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide 2,3-dimethoxy-N-methyl-N-[(2-pyr…

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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) 3.13 10 -13.69 0 5 0 42 354.45 6 ↓

Analogs

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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) 2.82 12.62 -11.09 0 8 0 96 397.431 7 ↓

Analogs

39678262
39678262
39678263
39678263

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Popular Name: 2,4-dimethoxy-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide 2,4-dimethoxy-N-methyl-N-[(2-pyr…

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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) 3.35 11.05 -13.91 0 5 0 42 354.45 6 ↓

Analogs

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Popular Name: 5-bromo-2-hydroxy-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide 5-bromo-2-hydroxy-N-methyl-N-[(2…

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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) 4.03 10.32 -10.22 1 4 0 44 389.293 4 ↓
Hi High (pH 8-9.5) 4.03 11.31 -52.01 0 4 -1 47 388.285 4 ↓

Analogs

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Popular Name: N,2-dimethyl-3-nitro-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide N,2-dimethyl-3-nitro-N-[(2-pyrro…

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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) 3.07 12.57 -13.39 0 6 0 69 353.422 5 ↓

Analogs

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Popular Name: 4-methoxy-N-methyl-3-nitro-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide 4-methoxy-N-methyl-3-nitro-N-[(2…

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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) 2.70 12.07 -19.3 0 7 0 79 369.421 6 ↓

Analogs

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Popular Name: N,4-dimethyl-3,5-dinitro-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide N,4-dimethyl-3,5-dinitro-N-[(2-p…

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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) 2.98 12.87 -9.97 0 9 0 115 398.419 6 ↓

Analogs

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Popular Name: 3-acetamido-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide 3-acetamido-N-methyl-N-[(2-pyrro…

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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) 1.96 10.18 -21.5 1 5 0 53 351.45 5 ↓

Analogs

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Popular Name: N,4-dimethyl-3-nitro-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide N,4-dimethyl-3-nitro-N-[(2-pyrro…

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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) 3.10 12.59 -17.31 0 6 0 69 353.422 5 ↓

Analogs

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Popular Name: 3-chloro-4,5-dimethoxy-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide 3-chloro-4,5-dimethoxy-N-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) 3.21 11.13 -9.53 0 5 0 42 388.895 6 ↓

Analogs

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Popular Name: 2-hydroxy-4-methoxy-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide 2-hydroxy-4-methoxy-N-methyl-N-[…

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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) 3.28 9.02 -13.64 1 5 0 53 340.423 5 ↓
Hi High (pH 8-9.5) 3.28 10.01 -58.49 0 5 -1 56 339.415 5 ↓

Analogs

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Popular Name: N,3-dimethyl-2-nitro-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide N,3-dimethyl-2-nitro-N-[(2-pyrro…

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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) 3.07 13.52 -22.56 0 6 0 69 353.422 5 ↓

Analogs

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Popular Name: 3,5-difluoro-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide 3,5-difluoro-N-methyl-N-[(2-pyrr…

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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) 3.02 11.41 -8.19 0 3 0 24 330.378 4 ↓

Analogs

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Popular Name: 2-fluoro-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide 2-fluoro-N-methyl-N-[(2-pyrrolid…

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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) 2.88 11.34 -14.35 0 3 0 24 312.388 4 ↓

Analogs

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Popular Name: 2-methoxy-N-methyl-5-nitro-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide 2-methoxy-N-methyl-5-nitro-N-[(2…

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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) 3.25 12.44 -12.06 0 7 0 79 369.421 6 ↓

Analogs

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Popular Name: N-methyl-4-methylsulfonyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide N-methyl-4-methylsulfonyl-N-[(2-…

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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) 1.63 8.82 -17.01 0 5 0 58 372.49 5 ↓

Analogs

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Popular Name: 3-ethoxy-4-methoxy-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide 3-ethoxy-4-methoxy-N-methyl-N-[(…

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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 11.36 -14.11 0 5 0 42 368.477 7 ↓

Analogs

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Popular Name: N-methyl-2-(methylamino)-5-nitro-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide N-methyl-2-(methylamino)-5-nitro…

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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) 2.50 11.07 -10.06 1 7 0 81 368.437 6 ↓

Analogs

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Popular Name: 4-(2-amino-2-oxo-ethoxy)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide 4-(2-amino-2-oxo-ethoxy)-N-methy…

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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) 1.55 8.7 -17.75 2 6 0 76 367.449 7 ↓

Analogs

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Popular Name: 5-fluoro-2-nitro-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide 5-fluoro-2-nitro-N-[(2-pyrrolidi…

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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) 3.04 10.57 -12.07 1 6 0 78 343.358 5 ↓

Parameters Provided:

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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 = 28303 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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