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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-1-isopropyl-N-[(4R)-4,5,6,7-tetrahydrobenzothiophen-4-yl]pyrrole-2-carboxamide 4-amino-1-isopropyl-N-[(4R)-4,5,…

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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) 1.59 6.34 -8.7 3 4 0 60 303.431 3 ↓

Analogs

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Popular Name: 4-amino-1-isopropyl-N-[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]pyrrole-2-carboxamide 4-amino-1-isopropyl-N-[(4S)-4,5,…

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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) 1.59 6.18 -8.7 3 4 0 60 303.431 3 ↓

Analogs

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Popular Name: 4-amino-N-[(4R)-4,5,6,7-tetrahydrobenzothiophen-4-yl]-1H-pyrrole-2-carboxamide 4-amino-N-[(4R)-4,5,6,7-tetrahyd…

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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) 0.78 3.23 -11.55 4 4 0 71 261.35 2 ↓

Analogs

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Popular Name: 4-amino-N-[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]-1H-pyrrole-2-carboxamide 4-amino-N-[(4S)-4,5,6,7-tetrahyd…

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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) 0.78 3.07 -11.48 4 4 0 71 261.35 2 ↓

Analogs

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Popular Name: 4-amino-1-ethyl-N-[(4R)-4,5,6,7-tetrahydrobenzothiophen-4-yl]pyrrole-2-carboxamide 4-amino-1-ethyl-N-[(4R)-4,5,6,7-…

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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) 1.23 5.76 -8.67 3 4 0 60 289.404 3 ↓

Analogs

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Popular Name: 4-amino-1-ethyl-N-[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]pyrrole-2-carboxamide 4-amino-1-ethyl-N-[(4S)-4,5,6,7-…

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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) 1.23 5.6 -8.65 3 4 0 60 289.404 3 ↓

Analogs

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Popular Name: 4-amino-1-methyl-N-[(4R)-4,5,6,7-tetrahydrobenzothiophen-4-yl]pyrrole-2-carboxamide 4-amino-1-methyl-N-[(4R)-4,5,6,7…

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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) 0.85 4.89 -9.12 3 4 0 60 275.377 2 ↓

Analogs

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Popular Name: 4-amino-1-methyl-N-[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]pyrrole-2-carboxamide 4-amino-1-methyl-N-[(4S)-4,5,6,7…

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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) 0.85 4.72 -9.09 3 4 0 60 275.377 2 ↓

Analogs

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Popular Name: 4-amino-1-propyl-N-[(4R)-4,5,6,7-tetrahydrobenzothiophen-4-yl]pyrrole-2-carboxamide 4-amino-1-propyl-N-[(4R)-4,5,6,7…

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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) 1.73 6.56 -8.49 3 4 0 60 303.431 4 ↓

Analogs

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Popular Name: 4-amino-1-propyl-N-[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]pyrrole-2-carboxamide 4-amino-1-propyl-N-[(4S)-4,5,6,7…

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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) 1.73 6.36 -8.49 3 4 0 60 303.431 4 ↓

Analogs

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Popular Name: 4-bromo-1-methyl-N-[(4R)-4,5,6,7-tetrahydrobenzothiophen-4-yl]pyrrole-2-carboxamide 4-bromo-1-methyl-N-[(4R)-4,5,6,7…

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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) 2.18 7.66 -8 1 3 0 34 339.258 2 ↓

Analogs

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Popular Name: 4-bromo-1-methyl-N-[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]pyrrole-2-carboxamide 4-bromo-1-methyl-N-[(4S)-4,5,6,7…

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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) 2.18 7.49 -8.05 1 3 0 34 339.258 2 ↓

Analogs

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Popular Name: 4-bromo-1-ethyl-N-[(4R)-4,5,6,7-tetrahydrobenzothiophen-4-yl]pyrrole-2-carboxamide 4-bromo-1-ethyl-N-[(4R)-4,5,6,7-…

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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) 2.55 8.54 -7.55 1 3 0 34 353.285 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-bromo-1-ethyl-N-[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]pyrrole-2-carboxamide 4-bromo-1-ethyl-N-[(4S)-4,5,6,7-…

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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) 2.55 8.38 -7.62 1 3 0 34 353.285 3 ↓

Analogs

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Popular Name: 4-bromo-N-[(4R)-4,5,6,7-tetrahydrobenzothiophen-4-yl]-1H-pyrrole-2-carboxamide 4-bromo-N-[(4R)-4,5,6,7-tetrahyd…

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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) 2.11 5.98 -11.57 2 3 0 45 325.231 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-bromo-N-[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]-1H-pyrrole-2-carboxamide 4-bromo-N-[(4S)-4,5,6,7-tetrahyd…

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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) 2.11 5.83 -11.38 2 3 0 45 325.231 2 ↓

Analogs

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Popular Name: 4-bromo-1-isopropyl-N-[(4R)-4,5,6,7-tetrahydrobenzothiophen-4-yl]pyrrole-2-carboxamide 4-bromo-1-isopropyl-N-[(4R)-4,5,…

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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) 2.92 9.1 -7.52 1 3 0 34 367.312 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-bromo-1-isopropyl-N-[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]pyrrole-2-carboxamide 4-bromo-1-isopropyl-N-[(4S)-4,5,…

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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) 2.92 8.94 -7.51 1 3 0 34 367.312 3 ↓

Parameters Provided:

ring.id = 210814
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 = 210814 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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