UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

20602990
20602990

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Popular Name: 3-cyclopropyl-1-(4-methoxyphenyl)-6-methyl-4-(trifluoromethyl)pyrazolo[5,4-b]pyridine 3-cyclopropyl-1-(4-methoxyphenyl…

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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) 3.98 9.98 -9.4 0 4 0 40 347.34 4 ↓

Analogs

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Popular Name: 3-cyclopropyl-6-ethyl-1-(4-methoxyphenyl)-4-(trifluoromethyl)pyrazolo[5,4-b]pyridine 3-cyclopropyl-6-ethyl-1-(4-metho…

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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) 4.55 10.81 -8.91 0 4 0 40 361.367 5 ↓

Analogs

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Popular Name: ethyl ethyl

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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) 4.13 3.41 -12.57 0 5 0 57 353.397 6 ↓

Analogs

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Popular Name: ethyl ethyl

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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) 3.86 2.45 -9.86 0 6 0 66 365.433 7 ↓

Analogs

36621660
36621660
36621661
36621661
36621700
36621700
36621742
36621742

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Popular Name: 3-cyclopropyl-6-ethyl-1-(2-fluorophenyl)pyrazolo[5,4-b]pyridine-4-carboxylic 3-cyclopropyl-6-ethyl-1-(2-fluor…

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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) 3.50 1.89 -50.71 0 5 -1 71 324.335 4 ↓

Analogs

36615361
36615361

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Popular Name: ethyl ethyl

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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) 3.80 2.43 -9.99 0 5 0 57 335.407 6 ↓

Analogs

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Popular Name: ethyl ethyl

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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) 3.97 3.17 -7.97 0 5 0 57 353.397 6 ↓

Analogs

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Popular Name: 3-cyclopropyl-6-ethyl-1-phenyl-pyrazolo[5,4-b]pyridine-4-carboxylic 3-cyclopropyl-6-ethyl-1-phenyl-p…

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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 0.91 -48.45 0 5 -1 71 306.345 4 ↓

Analogs

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Popular Name: 3-cyclopropyl-6-ethyl-1-(4-fluorophenyl)pyrazolo[5,4-b]pyridine-4-carboxylic 3-cyclopropyl-6-ethyl-1-(4-fluor…

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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) 3.33 1.65 -44.77 0 5 -1 71 324.335 4 ↓

Analogs

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Popular Name: 3-cyclopropyl-6-ethyl-1-(4-methoxyphenyl)pyrazolo[5,4-b]pyridine-4-carboxylic 3-cyclopropyl-6-ethyl-1-(4-metho…

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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) 3.23 0.92 -47.61 0 6 -1 80 336.371 5 ↓

Parameters Provided:

ring.id = 74515
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 = 74515 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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