UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 2-[2-(9H-fluoren-9-ylamino)-2-oxo-ethoxy]benzoic 2-[2-(9H-fluoren-9-ylamino)-2-ox…

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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) 4.16 10.7 -75.67 1 5 -1 78 358.373 5 ↓

Analogs

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Popular Name: 4-[2-(9H-fluoren-9-ylamino)-2-oxo-ethoxy]benzoic 4-[2-(9H-fluoren-9-ylamino)-2-ox…

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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) 4.12 10.21 -57.07 1 5 -1 78 358.373 5 ↓

Analogs

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Popular Name: 3-[2-(9H-fluoren-9-ylamino)-2-oxo-ethoxy]benzoic 3-[2-(9H-fluoren-9-ylamino)-2-ox…

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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) 4.10 10.2 -64.5 1 5 -1 78 358.373 5 ↓

Analogs

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Popular Name: 4-[2-(9H-fluoren-9-ylamino)-2-oxo-ethoxy]-3-methoxy-benzoic 4-[2-(9H-fluoren-9-ylamino)-2-ox…

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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) 3.71 9.96 -58.33 1 6 -1 88 388.399 6 ↓

Analogs

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Popular Name: 2-[4-[2-(9H-fluoren-9-ylamino)-2-oxo-ethoxy]phenyl]acetic 2-[4-[2-(9H-fluoren-9-ylamino)-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) 3.64 11.01 -55.61 1 5 -1 78 372.4 6 ↓

Analogs

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Popular Name: 4-[2-(9H-fluoren-9-ylamino)-2-oxo-ethoxy]benzene-1,3-dicarboxylic 4-[2-(9H-fluoren-9-ylamino)-2-ox…

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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) 4.04 10.33 -133.59 1 7 -2 119 401.374 6 ↓

Parameters Provided:

ring.id = 138381
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 = 138381 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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