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

Analogs

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Popular Name: 5-[2-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxo-ethyl]-3,7-dimethyl-2-phenyl-pyrazolo[3,4-d]pyridazin 5-[2-[4-(3-methoxyphenyl)piperaz…

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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) 2.49 10.04 -20.84 0 9 0 86 472.549 5 ↓

Analogs

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Popular Name: 5-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxo-ethyl]-3,7-dimethyl-2-phenyl-pyrazolo[3,4-d]pyridazin- 5-[2-[4-(3-chlorophenyl)piperazi…

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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) 3.11 11.25 -19.56 0 8 0 76 476.968 4 ↓

Analogs

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Popular Name: 5-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxo-ethyl]-3,7-dimethyl-2-phenyl-pyrazolo[3,4-d]pyrida 5-[2-[4-(2,3-dimethylphenyl)pipe…

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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 12.77 -18.06 0 8 0 76 470.577 4 ↓

Analogs

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Popular Name: 5-[2-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-2-oxo-ethyl]-3,7-dimethyl-2-phenyl-pyrazolo[3,4-d] 5-[2-[4-(5-chloro-2-methyl-pheny…

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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) 3.51 12.75 -18.27 0 8 0 76 490.995 4 ↓

Analogs

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Popular Name: 3,7-dimethyl-5-[2-[(3S)-3-methyl-4-(m-tolyl)piperazin-1-yl]-2-oxo-ethyl]-2-phenyl-pyrazolo[3,4-d]pyr 3,7-dimethyl-5-[2-[(3S)-3-methyl…

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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) 3.21 12.09 -17.97 0 8 0 76 470.577 4 ↓

Analogs

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Popular Name: 3,7-dimethyl-5-[2-[(3R)-3-methyl-4-(m-tolyl)piperazin-1-yl]-2-oxo-ethyl]-2-phenyl-pyrazolo[3,4-d]pyr 3,7-dimethyl-5-[2-[(3R)-3-methyl…

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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) 3.21 12.28 -18.48 0 8 0 76 470.577 4 ↓

Parameters Provided:

ring.id = 371092
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 = 371092 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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