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

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Popular Name: 4-[(2R)-2-(1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]-N-prop-2-ynyl-benzenesulfonamide 4-[(2R)-2-(1H-benzimidazol-2-yl)…

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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) 1.71 5.41 -20.5 2 7 0 95 408.483 5 ↓

Analogs

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Popular Name: 4-[(2S)-2-(1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]-N-prop-2-ynyl-benzenesulfonamide 4-[(2S)-2-(1H-benzimidazol-2-yl)…

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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) 1.71 5.38 -21.44 2 7 0 95 408.483 5 ↓

Analogs

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Popular Name: [(2R)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-[2-(trifluoromethyl)phenyl]methanone [(2R)-2-(1H-benzimidazol-2-yl)py…

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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) 3.33 8.95 -17.88 1 4 0 49 359.351 3 ↓
Lo Low (pH 4.5-6) 3.33 9.46 -33.96 2 4 1 50 360.359 3 ↓

Analogs

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Popular Name: [(2S)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-[2-(trifluoromethyl)phenyl]methanone [(2S)-2-(1H-benzimidazol-2-yl)py…

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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) 3.33 8.85 -18.38 1 4 0 49 359.351 3 ↓
Lo Low (pH 4.5-6) 3.33 9.37 -33 2 4 1 50 360.359 3 ↓

Analogs

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Popular Name: [(2R)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(2-methyl-3-nitro-phenyl)methanone [(2R)-2-(1H-benzimidazol-2-yl)py…

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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) 2.80 9.05 -18.49 1 7 0 95 350.378 3 ↓
Lo Low (pH 4.5-6) 2.80 9.55 -39.2 2 7 1 96 351.386 3 ↓

Analogs

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Popular Name: [(2S)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(2-methyl-3-nitro-phenyl)methanone [(2S)-2-(1H-benzimidazol-2-yl)py…

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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) 2.80 9.17 -17.56 1 7 0 95 350.378 3 ↓
Lo Low (pH 4.5-6) 2.80 9.69 -40.02 2 7 1 96 351.386 3 ↓

Analogs

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Popular Name: [(2S)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(2-chloro-4,5-difluoro-phenyl)methanone [(2S)-2-(1H-benzimidazol-2-yl)py…

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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 8.56 -13.16 1 4 0 49 361.779 2 ↓
Lo Low (pH 4.5-6) 3.35 9.07 -32.16 2 4 1 50 362.787 2 ↓

Analogs

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Popular Name: [(2R)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(2-chloro-4,5-difluoro-phenyl)methanone [(2R)-2-(1H-benzimidazol-2-yl)py…

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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 8.49 -13.6 1 4 0 49 361.779 2 ↓
Lo Low (pH 4.5-6) 3.35 9 -31.86 2 4 1 50 362.787 2 ↓

Analogs

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Popular Name: [(2R)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(2,4,5-trimethoxyphenyl)methanone [(2R)-2-(1H-benzimidazol-2-yl)py…

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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) 2.66 7.49 -20.23 1 7 0 77 381.432 5 ↓
Lo Low (pH 4.5-6) 2.66 7.99 -34.97 2 7 1 78 382.44 5 ↓

Analogs

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Popular Name: [(2S)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(2,4,5-trimethoxyphenyl)methanone [(2S)-2-(1H-benzimidazol-2-yl)py…

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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) 2.66 7.43 -20.77 1 7 0 77 381.432 5 ↓
Lo Low (pH 4.5-6) 2.66 7.95 -34.49 2 7 1 78 382.44 5 ↓

Analogs

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Popular Name: [(2R)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(3-methyl-2-nitro-phenyl)methanone [(2R)-2-(1H-benzimidazol-2-yl)py…

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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) 2.80 10.05 -25.09 1 7 0 95 350.378 3 ↓
Lo Low (pH 4.5-6) 2.80 10.56 -40.66 2 7 1 96 351.386 3 ↓

Analogs

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Popular Name: [(2S)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(3-methyl-2-nitro-phenyl)methanone [(2S)-2-(1H-benzimidazol-2-yl)py…

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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) 2.80 9.98 -25.91 1 7 0 95 350.378 3 ↓
Lo Low (pH 4.5-6) 2.80 10.5 -39.66 2 7 1 96 351.386 3 ↓

Analogs

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Popular Name: [(2R)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(5-chloro-2-methoxy-phenyl)methanone [(2R)-2-(1H-benzimidazol-2-yl)py…

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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) 3.70 8.78 -17.29 1 5 0 58 355.825 3 ↓
Lo Low (pH 4.5-6) 3.70 9.28 -30.29 2 5 1 59 356.833 3 ↓

Analogs

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Popular Name: [(2S)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(5-chloro-2-methoxy-phenyl)methanone [(2S)-2-(1H-benzimidazol-2-yl)py…

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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) 3.70 8.69 -17.71 1 5 0 58 355.825 3 ↓
Lo Low (pH 4.5-6) 3.70 9.2 -29.89 2 5 1 59 356.833 3 ↓

Analogs

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Popular Name: [(2R)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(3,5-dimethoxy-4-methyl-phenyl)methanone [(2R)-2-(1H-benzimidazol-2-yl)py…

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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) 2.90 7.32 -17.1 1 6 0 67 365.433 4 ↓
Lo Low (pH 4.5-6) 2.90 7.83 -33.63 2 6 1 69 366.441 4 ↓

Analogs

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Popular Name: [(2S)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(3,5-dimethoxy-4-methyl-phenyl)methanone [(2S)-2-(1H-benzimidazol-2-yl)py…

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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) 2.90 7.28 -17.52 1 6 0 67 365.433 4 ↓
Lo Low (pH 4.5-6) 2.90 7.8 -33.44 2 6 1 69 366.441 4 ↓

Analogs

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Popular Name: [(2R)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(2,5-dimethoxyphenyl)methanone [(2R)-2-(1H-benzimidazol-2-yl)py…

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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) 3.08 7.54 -19.39 1 6 0 67 351.406 4 ↓
Lo Low (pH 4.5-6) 3.08 8.05 -30.52 2 6 1 69 352.414 4 ↓

Analogs

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Popular Name: [(2S)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(2,5-dimethoxyphenyl)methanone [(2S)-2-(1H-benzimidazol-2-yl)py…

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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) 3.08 7.46 -19.69 1 6 0 67 351.406 4 ↓
Lo Low (pH 4.5-6) 3.08 7.98 -30.13 2 6 1 69 352.414 4 ↓

Analogs

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Popular Name: [(2S)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(2-bromo-4-fluoro-phenyl)methanone [(2S)-2-(1H-benzimidazol-2-yl)py…

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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) 3.39 8.62 -14.24 1 4 0 49 388.24 2 ↓
Lo Low (pH 4.5-6) 3.39 9.13 -33.26 2 4 1 50 389.248 2 ↓

Analogs

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Popular Name: [(2R)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(2-bromo-4-fluoro-phenyl)methanone [(2R)-2-(1H-benzimidazol-2-yl)py…

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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) 3.39 8.55 -14.78 1 4 0 49 388.24 2 ↓
Lo Low (pH 4.5-6) 3.39 9.06 -32.67 2 4 1 50 389.248 2 ↓

Analogs

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Popular Name: [(2R)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(3-dimethylaminophenyl)methanone [(2R)-2-(1H-benzimidazol-2-yl)py…

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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) 2.56 -1.79 -17.35 1 5 0 52 334.423 3 ↓

Analogs

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Popular Name: [(2S)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(3-dimethylaminophenyl)methanone [(2S)-2-(1H-benzimidazol-2-yl)py…

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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) 2.56 -1.72 -19.35 1 5 0 52 334.423 3 ↓

Analogs

12221409
12221409

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Popular Name: [(2R)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(3,4-dimethoxyphenyl)methanone [(2R)-2-(1H-benzimidazol-2-yl)py…

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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) 2.13 -1.29 -19.09 1 6 0 67 351.406 4 ↓

Analogs

12221408
12221408

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Popular Name: [(2S)-2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(3,4-dimethoxyphenyl)methanone [(2S)-2-(1H-benzimidazol-2-yl)py…

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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) 2.13 -1.39 -21.33 1 6 0 67 351.406 4 ↓

Analogs

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Popular Name: N-[3-[(2R)-2-(1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]phenyl]methanesulfonamide N-[3-[(2R)-2-(1H-benzimidazol-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) 1.69 4.64 -23.62 2 7 0 95 384.461 4 ↓

Analogs

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Popular Name: N-[3-[(2S)-2-(1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]phenyl]methanesulfonamide N-[3-[(2S)-2-(1H-benzimidazol-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) 1.69 4.65 -56.35 1 7 -1 97 383.453 4 ↓
Lo Low (pH 4.5-6) 1.69 5.16 -54.41 2 7 0 98 384.461 4 ↓
Lo Low (pH 4.5-6) 1.69 4.58 -21.27 2 7 0 95 384.461 4 ↓

Analogs

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Popular Name: N,N-diethyl-4-[(2R)-2-(1-methylbenzimidazol-2-yl)pyrrolidine-1-carbonyl]benzenesulfonamide N,N-diethyl-4-[(2R)-2-(1-methylb…

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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) 2.62 9.02 -19.37 0 7 0 76 440.569 6 ↓
Lo Low (pH 4.5-6) 2.62 9.76 -36.09 1 7 1 77 441.577 6 ↓

Analogs

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Popular Name: N,N-diethyl-4-[(2S)-2-(1-methylbenzimidazol-2-yl)pyrrolidine-1-carbonyl]benzenesulfonamide N,N-diethyl-4-[(2S)-2-(1-methylb…

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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) 2.62 8.99 -19.67 0 7 0 76 440.569 6 ↓
Lo Low (pH 4.5-6) 2.62 9.9 -35.68 1 7 1 77 441.577 6 ↓

Analogs

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Popular Name: 3-[(2S)-2-(1-ethylbenzimidazol-2-yl)pyrrolidine-1-carbonyl]benzonitrile 3-[(2S)-2-(1-ethylbenzimidazol-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) 2.66 10.59 -16.4 0 5 0 62 344.418 3 ↓
Lo Low (pH 4.5-6) 2.66 11.3 -30.21 1 5 1 63 345.426 3 ↓

Analogs

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Popular Name: 3-[(2R)-2-(1-ethylbenzimidazol-2-yl)pyrrolidine-1-carbonyl]benzonitrile 3-[(2R)-2-(1-ethylbenzimidazol-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) 2.66 10.56 -19.42 0 5 0 62 344.418 3 ↓
Lo Low (pH 4.5-6) 2.66 11.4 -34.38 1 5 1 63 345.426 3 ↓

Analogs

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Popular Name: 2-[2-[(2S)-2-(4-methyl-1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]anilino]acetic 2-[2-[(2S)-2-(4-methyl-1H-benzim…

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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) 1.03 8.51 -62.33 2 7 -1 101 377.424 5 ↓
Lo Low (pH 4.5-6) 1.03 8.93 -58.36 3 7 0 102 378.432 5 ↓

Analogs

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Popular Name: 2-[2-[(2R)-2-(4-methyl-1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]anilino]acetic 2-[2-[(2R)-2-(4-methyl-1H-benzim…

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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) 1.03 8.43 -62.8 2 7 -1 101 377.424 5 ↓
Lo Low (pH 4.5-6) 1.03 8.84 -57.09 3 7 0 102 378.432 5 ↓

Parameters Provided:

ring.id = 7005
filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

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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 = 7005 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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