UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 5-amino-2-(5-methylthiazol-2-yl)isoindoline-1,3-dione 5-amino-2-(5-methylthiazol-2-yl)…

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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) 1.55 4.25 -16.52 2 5 0 78 259.29 1 ↓

Analogs

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Popular Name: 4-amino-2-(5-methylthiazol-2-yl)isoindoline-1,3-dione 4-amino-2-(5-methylthiazol-2-yl)…

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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) 1.62 4.37 -15.44 2 5 0 78 259.29 1 ↓

Analogs

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Popular Name: 5-amino-2-thiazol-2-yl-isoindoline-1,3-dione 5-amino-2-thiazol-2-yl-isoindoli…

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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) 1.33 3.43 -16.51 2 5 0 78 245.263 1 ↓

Analogs

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Popular Name: 4-amino-2-thiazol-2-yl-isoindoline-1,3-dione 4-amino-2-thiazol-2-yl-isoindoli…

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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) 1.40 3.55 -15.12 2 5 0 78 245.263 1 ↓

Analogs

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Popular Name: 5-amino-2-(4-methylthiazol-2-yl)isoindoline-1,3-dione 5-amino-2-(4-methylthiazol-2-yl)…

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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) 1.55 4.03 -16.82 2 5 0 78 259.29 1 ↓

Analogs

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Popular Name: 4-amino-2-(4-methylthiazol-2-yl)isoindoline-1,3-dione 4-amino-2-(4-methylthiazol-2-yl)…

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Activity (Go SEA)

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) 1.62 4.15 -16.07 2 5 0 78 259.29 1 ↓

Analogs

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Popular Name: 5-amino-2-(4-isopropylthiazol-2-yl)isoindoline-1,3-dione 5-amino-2-(4-isopropylthiazol-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) 2.61 5.25 -14.99 2 5 0 78 287.344 2 ↓

Analogs

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Popular Name: 4-amino-2-(4-isopropylthiazol-2-yl)isoindoline-1,3-dione 4-amino-2-(4-isopropylthiazol-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) 2.68 5.34 -15.27 2 5 0 78 287.344 2 ↓

Analogs

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Popular Name: 2-[2-(5-methyl-1,3-dioxo-isoindolin-2-yl)thiazol-4-yl]acetic 2-[2-(5-methyl-1,3-dioxo-isoindo…

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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) 2.37 7.59 -65.94 0 6 -1 92 301.303 3 ↓

Analogs

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Popular Name: 2-[2-(5-bromo-1,3-dioxo-isoindolin-2-yl)thiazol-4-yl]acetic 2-[2-(5-bromo-1,3-dioxo-isoindol…

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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) 2.73 7.54 -61.41 0 6 -1 92 366.172 3 ↓

Parameters Provided:

ring.id = 70980
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 = 70980 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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