UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: imidazolidine, 2-(4-methoxy-3-methylphenyl)-1,3-diphenyl- imidazolidine, 2-(4-methoxy-3-me…

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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) 5.63 8.85 -6.06 0 3 0 16 344.458 4 ↓

Analogs

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Popular Name: imidazolidine, 2-(2-chloro-6-fluorophenyl)-1,3-diphenyl- imidazolidine, 2-(2-chloro-6-flu…

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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) 5.94 10.56 -6.68 0 2 0 6 352.84 3 ↓

Analogs

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Popular Name: imidazolidine, 2-(2-chloro-4-fluorophenyl)-1,3-diphenyl- imidazolidine, 2-(2-chloro-4-flu…

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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) 5.97 10.51 -4.8 0 2 0 6 352.84 3 ↓

Analogs

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Popular Name: imidazolidine, 2-(4-methoxy-2,3-dimethylphenyl)-1,3-diphenyl- imidazolidine, 2-(4-methoxy-2,3-…

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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) 6.01 9.92 -5.67 0 3 0 16 358.485 4 ↓

Analogs

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Popular Name: imidazolidine, 2-(3-fluorophenyl)-1,3-diphenyl- imidazolidine, 2-(3-fluorophenyl…

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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) 5.34 8.88 -4.96 0 2 0 6 318.395 3 ↓

Analogs

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Popular Name: 4-[1,3-bis(p-tolyl)imidazolidin-2-yl]-2,6-dibromo-phenol 4-[1,3-bis(p-tolyl)imidazolidin-…

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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) 7.35 11.54 -5.28 1 3 0 27 502.25 3 ↓
Hi High (pH 8-9.5) 7.35 12.3 -40.93 0 3 -1 30 501.242 3 ↓

Analogs

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Popular Name: imidazolidine, 2-(2-chloro-4,5-dimethoxyphenyl)-1,3-diphenyl- imidazolidine, 2-(2-chloro-4,5-d…

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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) 5.45 11.71 -7.01 0 4 0 25 394.902 5 ↓

Parameters Provided:

ring.id = 231016
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 = 231016 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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