UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

44503713
44503713

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Popular Name: N-(cyclobutylmethyl)-1H-indole-2-carboxamide N-(cyclobutylmethyl)-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) 2.64 5.65 -11.96 2 3 0 45 228.295 3 ↓

Analogs

27154106
27154106
27154109
27154109
44385489
44385489
58249275
58249275
23170955
23170955

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Popular Name: 5-chloro-N-(cyclobutylmethyl)-1H-indole-2-carboxamide 5-chloro-N-(cyclobutylmethyl)-1H…

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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) 3.29 6.17 -12.13 2 3 0 45 262.74 3 ↓

Analogs

30420885
30420885
48209561
48209561
48222121
48222121
48465410
48465410
48781235
48781235

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Popular Name: N-(cyclobutylmethyl)-6-methoxy-1H-indole-2-carboxamide N-(cyclobutylmethyl)-6-methoxy-1…

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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) 2.67 5 -11.83 2 4 0 54 258.321 4 ↓

Analogs

32755374
32755374
44287988
44287988
44341406
44341406
44776740
44776740

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Popular Name: 6-bromo-N-(cyclobutylmethyl)-1H-indole-2-carboxamide 6-bromo-N-(cyclobutylmethyl)-1H-…

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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) 3.42 6.25 -10.55 2 3 0 45 307.191 3 ↓

Analogs

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Popular Name: N-(cyclobutylmethyl)-N-methyl-1H-indole-2-carboxamide N-(cyclobutylmethyl)-N-methyl-1H…

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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 7.96 -9.79 1 3 0 36 242.322 3 ↓

Analogs

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Popular Name: 7-amino-N-(cyclobutylmethyl)-N-methyl-1H-indole-2-carboxamide 7-amino-N-(cyclobutylmethyl)-N-m…

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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) 2.32 5.85 -10.56 3 4 0 62 257.337 3 ↓

Analogs

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Popular Name: 5-amino-N-(cyclobutylmethyl)-N-methyl-1H-indole-2-carboxamide 5-amino-N-(cyclobutylmethyl)-N-m…

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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) 1.93 5.83 -10.89 3 4 0 62 257.337 3 ↓

Analogs

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Popular Name: N-(cyclobutylmethyl)-6-ethoxy-1H-indole-2-carboxamide N-(cyclobutylmethyl)-6-ethoxy-1H…

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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 5.84 -8.43 2 4 0 54 272.348 5 ↓

Analogs

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Popular Name: 3-chloro-N-(cyclobutylmethyl)-1H-indole-2-carboxamide 3-chloro-N-(cyclobutylmethyl)-1H…

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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) 3.24 6.12 -9.51 2 3 0 45 262.74 3 ↓

Analogs

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Popular Name: 5-bromo-3-chloro-N-(cyclobutylmethyl)-1H-indole-2-carboxamide 5-bromo-3-chloro-N-(cyclobutylme…

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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 6.77 -9.3 2 3 0 45 341.636 3 ↓

Analogs

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Popular Name: 3-chloro-N-(cyclobutylmethyl)-5-fluoro-1H-indole-2-carboxamide 3-chloro-N-(cyclobutylmethyl)-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) 2.41 6.19 -10.28 2 3 0 45 280.73 3 ↓

Analogs

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Popular Name: 3-bromo-N-(cyclobutylmethyl)-1H-indole-2-carboxamide 3-bromo-N-(cyclobutylmethyl)-1H-…

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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) 3.37 6.24 -9.21 2 3 0 45 307.191 3 ↓

Analogs

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Popular Name: N-(cyclobutylmethyl)-1-methyl-indole-2-carboxamide N-(cyclobutylmethyl)-1-methyl-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) 2.70 7.19 -7.99 1 3 0 34 242.322 3 ↓

Parameters Provided:

ring.id = 148356
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 = 148356 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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