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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

25802235
25802235
42327862
42327862
42327865
42327865
42327868
42327868
42327871
42327871

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Popular Name: N-(cyclohexylmethyl)-1H-indole-2-carboxamide N-(cyclohexylmethyl)-1H-indole-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) 3.88 6.94 -11.52 2 3 0 45 256.349 3 ↓

Analogs

8140034
8140034
8140037
8140037
8140038
8140038

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Popular Name: N-[(1S)-1-cyclohexylethyl]-1H-indole-2-carboxamide N-[(1S)-1-cyclohexylethyl]-1H-in…

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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) 4.21 7.46 -8.07 2 3 0 45 270.376 3 ↓

Analogs

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Popular Name: N-[(1R)-1-cyclohexylethyl]-1H-indole-2-carboxamide N-[(1R)-1-cyclohexylethyl]-1H-in…

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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) 4.21 7.75 -8.3 2 3 0 45 270.376 3 ↓

Analogs

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Popular Name: N-[(1S)-1-cyclohexylpropyl]-1H-indole-2-carboxamide N-[(1S)-1-cyclohexylpropyl]-1H-i…

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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) 4.75 8.36 -7.85 2 3 0 45 284.403 4 ↓

Analogs

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Popular Name: N-[(1R)-1-cyclohexylpropyl]-1H-indole-2-carboxamide N-[(1R)-1-cyclohexylpropyl]-1H-i…

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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) 4.75 8.47 -7.38 2 3 0 45 284.403 4 ↓

Analogs

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Popular Name: 7-amino-N-[[(1S,2R)-2-methylcyclohexyl]methyl]-1H-indole-2-carboxamide 7-amino-N-[[(1S,2R)-2-methylcycl…

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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) 3.56 5.11 -8.73 4 4 0 71 285.391 3 ↓

Analogs

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Popular Name: 7-amino-N-[[(1S,2S)-2-methylcyclohexyl]methyl]-1H-indole-2-carboxamide 7-amino-N-[[(1S,2S)-2-methylcycl…

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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) 3.56 5.34 -8.75 4 4 0 71 285.391 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-amino-N-[[(1R,2R)-2-methylcyclohexyl]methyl]-1H-indole-2-carboxamide 7-amino-N-[[(1R,2R)-2-methylcycl…

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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) 3.56 5.34 -8.76 4 4 0 71 285.391 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-amino-N-[[(1R,2S)-2-methylcyclohexyl]methyl]-1H-indole-2-carboxamide 7-amino-N-[[(1R,2S)-2-methylcycl…

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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) 3.56 5.11 -8.71 4 4 0 71 285.391 3 ↓

Analogs

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Popular Name: 7-amino-N-[(1S)-1-cyclohexylethyl]-1H-indole-2-carboxamide 7-amino-N-[(1S)-1-cyclohexylethy…

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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) 3.65 5.36 -8.77 4 4 0 71 285.391 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-amino-N-[(1R)-1-cyclohexylethyl]-1H-indole-2-carboxamide 7-amino-N-[(1R)-1-cyclohexylethy…

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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) 3.65 5.65 -9.06 4 4 0 71 285.391 3 ↓

Analogs

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Popular Name: 5-amino-N-[[(1S,2R)-2-methylcyclohexyl]methyl]-1H-indole-2-carboxamide 5-amino-N-[[(1S,2R)-2-methylcycl…

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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) 3.17 5.07 -9.05 4 4 0 71 285.391 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-amino-N-[[(1S,2S)-2-methylcyclohexyl]methyl]-1H-indole-2-carboxamide 5-amino-N-[[(1S,2S)-2-methylcycl…

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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) 3.17 5.31 -9.06 4 4 0 71 285.391 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-amino-N-[[(1R,2R)-2-methylcyclohexyl]methyl]-1H-indole-2-carboxamide 5-amino-N-[[(1R,2R)-2-methylcycl…

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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) 3.17 5.31 -9.06 4 4 0 71 285.391 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-amino-N-[[(1R,2S)-2-methylcyclohexyl]methyl]-1H-indole-2-carboxamide 5-amino-N-[[(1R,2S)-2-methylcycl…

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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) 3.17 5.08 -9.06 4 4 0 71 285.391 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-amino-N-[(1S)-1-cyclohexylethyl]-1H-indole-2-carboxamide 5-amino-N-[(1S)-1-cyclohexylethy…

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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) 3.26 5.33 -9.16 4 4 0 71 285.391 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-amino-N-[(1R)-1-cyclohexylethyl]-1H-indole-2-carboxamide 5-amino-N-[(1R)-1-cyclohexylethy…

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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) 3.26 5.62 -9.39 4 4 0 71 285.391 3 ↓

Parameters Provided:

ring.id = 82106
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 = 82106 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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