UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: (4-aminophenyl)-[methoxy(methyl)BLAHyl]methanone (4-aminophenyl)-[methoxy(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) 2.69 7.03 -13.18 2 6 0 74 352.39 3 ↓

Analogs

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Popular Name: N-[4-[methoxy(methyl)BLAHcarbonyl]phenyl]propanamide N-[4-[methoxy(methyl)BLAHcarbony…

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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) 3.67 8.91 -14.9 1 7 0 77 408.454 5 ↓

Analogs

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Popular Name: N-[4-[methoxy(methyl)BLAHcarbonyl]phenyl]-2-methyl-propanamide N-[4-[methoxy(methyl)BLAHcarbony…

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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) 3.91 9.57 -14.36 1 7 0 77 422.481 5 ↓

Analogs

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Popular Name: N-[4-[methoxy(methyl)BLAHcarbonyl]phenyl]acetamide N-[4-[methoxy(methyl)BLAHcarbony…

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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) 2.83 8.1 -15.26 1 7 0 77 394.427 4 ↓

Analogs

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Popular Name: N-[4-[methoxy(methyl)BLAHcarbonyl]phenyl]-3-methyl-butanamide N-[4-[methoxy(methyl)BLAHcarbony…

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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) 4.45 10.27 -14.17 1 7 0 77 436.508 6 ↓

Parameters Provided:

ring.id = 582213
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 = 582213 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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