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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-amino-N-[(1S)-2-imidazol-1-yl-1-methyl-ethyl]-1H-pyrrole-2-carboxamide 4-amino-N-[(1S)-2-imidazol-1-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) -0.29 2.78 -17.66 4 6 0 89 233.275 4 ↓
Mid Mid (pH 6-8) -0.29 3.29 -43.43 5 6 1 90 234.283 4 ↓
Mid Mid (pH 6-8) -0.73 1.44 -93.77 5 6 2 88 235.291 4 ↓

Analogs

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Popular Name: 4-amino-N-[(1R)-2-imidazol-1-yl-1-methyl-ethyl]-1H-pyrrole-2-carboxamide 4-amino-N-[(1R)-2-imidazol-1-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) -0.29 2.72 -17.21 4 6 0 89 233.275 4 ↓
Mid Mid (pH 6-8) -0.29 3.24 -45.14 5 6 1 90 234.283 4 ↓
Mid Mid (pH 6-8) -0.73 0.86 -55.7 4 6 1 87 234.283 4 ↓

Analogs

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Popular Name: 4-amino-N-[(1S)-2-imidazol-1-yl-1-methyl-ethyl]-1-methyl-pyrrole-2-carboxamide 4-amino-N-[(1S)-2-imidazol-1-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) -0.22 4.42 -14.7 3 6 0 78 247.302 4 ↓
Mid Mid (pH 6-8) -0.22 4.93 -39.83 4 6 1 79 248.31 4 ↓

Analogs

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Popular Name: 4-amino-N-[(1R)-2-imidazol-1-yl-1-methyl-ethyl]-1-methyl-pyrrole-2-carboxamide 4-amino-N-[(1R)-2-imidazol-1-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) -0.22 4.37 -14.59 3 6 0 78 247.302 4 ↓
Mid Mid (pH 6-8) -0.22 4.88 -40.76 4 6 1 79 248.31 4 ↓

Analogs

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Popular Name: 4-amino-1-ethyl-N-[(1S)-2-imidazol-1-yl-1-methyl-ethyl]pyrrole-2-carboxamide 4-amino-1-ethyl-N-[(1S)-2-imidaz…

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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) 0.15 5.29 -14.43 3 6 0 78 261.329 5 ↓
Mid Mid (pH 6-8) 0.15 5.8 -38.75 4 6 1 79 262.337 5 ↓

Analogs

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Popular Name: 4-amino-1-ethyl-N-[(1R)-2-imidazol-1-yl-1-methyl-ethyl]pyrrole-2-carboxamide 4-amino-1-ethyl-N-[(1R)-2-imidaz…

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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) 0.15 5.17 -17.57 3 6 0 78 261.329 5 ↓
Mid Mid (pH 6-8) 0.15 5.7 -44.4 4 6 1 79 262.337 5 ↓

Analogs

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Popular Name: 4-amino-N-[(1S)-2-imidazol-1-yl-1-methyl-ethyl]-1-propyl-pyrrole-2-carboxamide 4-amino-N-[(1S)-2-imidazol-1-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) 0.65 6.04 -14.36 3 6 0 78 275.356 6 ↓
Mid Mid (pH 6-8) 0.65 6.56 -38.58 4 6 1 79 276.364 6 ↓

Analogs

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Popular Name: 4-amino-N-[(1R)-2-imidazol-1-yl-1-methyl-ethyl]-1-propyl-pyrrole-2-carboxamide 4-amino-N-[(1R)-2-imidazol-1-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) 0.65 5.78 -17.2 3 6 0 78 275.356 6 ↓
Mid Mid (pH 6-8) 0.65 6.3 -40.65 4 6 1 79 276.364 6 ↓

Analogs

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Popular Name: 4-amino-N-[(1S)-2-imidazol-1-yl-1-methyl-ethyl]-1-isopropyl-pyrrole-2-carboxamide 4-amino-N-[(1S)-2-imidazol-1-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) 0.52 5.86 -14.28 3 6 0 78 275.356 5 ↓
Mid Mid (pH 6-8) 0.52 6.38 -39.2 4 6 1 79 276.364 5 ↓

Analogs

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Popular Name: 4-amino-N-[(1R)-2-imidazol-1-yl-1-methyl-ethyl]-1-isopropyl-pyrrole-2-carboxamide 4-amino-N-[(1R)-2-imidazol-1-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) 0.52 5.8 -14.29 3 6 0 78 275.356 5 ↓
Mid Mid (pH 6-8) 0.52 6.31 -40.06 4 6 1 79 276.364 5 ↓

Analogs

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Popular Name: 4,5-dichloro-N-(2-imidazol-1-ylethyl)-1-methyl-pyrrole-2-carboxamide 4,5-dichloro-N-(2-imidazol-1-yle…

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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) 1.44 7.03 -40.85 2 5 1 53 288.158 4 ↓
Mid Mid (pH 6-8) 1.44 6.51 -13.04 1 5 0 52 287.15 4 ↓

Analogs

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Popular Name: 4-chloro-N-(2-imidazol-1-ylethyl)-1-methyl-pyrrole-2-carboxamide 4-chloro-N-(2-imidazol-1-ylethyl…

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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) 0.64 6.67 -39.7 2 5 1 53 253.713 4 ↓
Mid Mid (pH 6-8) 0.64 6.16 -13.34 1 5 0 52 252.705 4 ↓

Analogs

37989338
37989338
37989339
37989339

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Popular Name: 4-chloro-N-(2-imidazol-1-ylethyl)-1H-pyrrole-2-carboxamide 4-chloro-N-(2-imidazol-1-ylethyl…

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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) 0.57 5.04 -44.56 3 5 1 64 239.686 4 ↓
Mid Mid (pH 6-8) 0.57 4.52 -17.44 2 5 0 63 238.678 4 ↓

Analogs

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Popular Name: 4-acetyl-N-(2-imidazol-1-ylethyl)-1H-pyrrole-2-carboxamide 4-acetyl-N-(2-imidazol-1-ylethyl…

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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) -0.21 5.06 -54.53 3 6 1 81 247.278 5 ↓
Mid Mid (pH 6-8) -0.21 4.55 -27.68 2 6 0 80 246.27 5 ↓

Analogs

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Popular Name: N-(2-imidazol-1-ylethyl)-1-methyl-4-(methylsulfamoyl)pyrrole-2-carboxamide N-(2-imidazol-1-ylethyl)-1-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) -0.97 2.26 -46.45 3 8 1 99 312.375 6 ↓
Mid Mid (pH 6-8) -0.97 1.74 -19.92 2 8 0 98 311.367 6 ↓

Parameters Provided:

ring.id = 33458
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 = 33458 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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