UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

21053610
21053610

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Popular Name: 5-(3-isopropyl-1,2,4-oxadiazol-5-yl)-4-methyl-thiophen-2-amine 5-(3-isopropyl-1,2,4-oxadiazol-5…

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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) 2.16 2.67 -7.94 1 4 0 63 223.301 2 ↓
Mid Mid (pH 6-8) 2.16 2.67 -7.12 1 4 0 63 223.301 2 ↓

Analogs

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Popular Name: 4-methyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)thiophen-2-amine 4-methyl-5-(3-methyl-1,2,4-oxadi…

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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) 1.11 1.6 -8.46 1 4 0 63 195.247 1 ↓
Mid Mid (pH 6-8) 1.11 1.6 -7.64 1 4 0 63 195.247 1 ↓

Analogs

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Popular Name: 5-[3-(2-methoxyethyl)-1,2,4-oxadiazol-5-yl]thiophen-2-amine 5-[3-(2-methoxyethyl)-1,2,4-oxad…

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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) 0.74 0.66 -8.86 1 5 0 72 225.273 4 ↓
Mid Mid (pH 6-8) 1.27 0.37 -9.08 2 5 0 74 225.273 4 ↓

Parameters Provided:

ring.id = 265029
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 = 265029 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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