UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: N-(4-methyl-2-pyridyl)-1H-indole-6-carboxamide N-(4-methyl-2-pyridyl)-1H-indole…

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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) 2.53 6.86 -17.73 2 4 0 58 251.289 2 ↓

Analogs

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Popular Name: N-(3-methyl-2-pyridyl)-1H-indole-6-carboxamide N-(3-methyl-2-pyridyl)-1H-indole…

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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) 2.53 6.97 -17.93 2 4 0 58 251.289 2 ↓

Analogs

14304627
14304627

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Popular Name: N-(2-pyridyl)-1H-indole-6-carboxamide N-(2-pyridyl)-1H-indole-6-carbox…

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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 6.19 -18.1 2 4 0 58 237.262 2 ↓

Analogs

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Popular Name: N-(6-methyl-2-pyridyl)-1H-indole-6-carboxamide N-(6-methyl-2-pyridyl)-1H-indole…

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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 6.78 -18.34 2 4 0 58 251.289 2 ↓

Analogs

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Popular Name: N-(3-hydroxy-2-pyridyl)-1H-indole-6-carboxamide N-(3-hydroxy-2-pyridyl)-1H-indol…

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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) 1.86 4.31 -20.55 3 5 0 82 253.261 2 ↓
Hi High (pH 8-9.5) 2.04 3.28 -55.96 2 5 -1 84 252.253 1 ↓
Mid Mid (pH 6-8) 1.86 3.23 -18.92 3 5 0 78 253.261 2 ↓

Analogs

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

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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) 3.28 6.72 -17.07 2 4 0 58 316.158 2 ↓

Analogs

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Popular Name: 1-methyl-N-(3-methyl-2-pyridyl)indole-6-carboxamide 1-methyl-N-(3-methyl-2-pyridyl)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) 2.60 8.72 -15.74 1 4 0 47 265.316 2 ↓

Parameters Provided:

ring.id = 12711
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 = 12711 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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