UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 5-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-6-methyl-benzimidazol-2-one 5-[4-(2-fluorophenyl)piperazin-1…

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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) 2.44 4.17 -14.13 2 7 0 89 390.44 3 ↓

Analogs

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Popular Name: 5-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-6-methyl-benzimidazol-2-one 5-[4-(3-chlorophenyl)piperazin-1…

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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) 2.98 4.19 -14.29 2 7 0 89 406.895 3 ↓

Analogs

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Popular Name: 5-methyl-6-(4-phenylpiperazin-1-yl)sulfonyl-benzimidazol-2-one 5-methyl-6-(4-phenylpiperazin-1-…

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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) 2.33 3.68 -14.01 2 7 0 89 372.45 3 ↓

Analogs

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Popular Name: 5-methyl-6-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonyl-benzimidazol-2-one 5-methyl-6-[4-[3-(trifluoromethy…

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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) 3.20 4.69 -15.12 2 7 0 89 440.447 4 ↓

Analogs

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Popular Name: 5-chloro-6-[(3S)-3-methyl-4-(m-tolyl)piperazin-1-yl]sulfonyl-benzimidazol-2-one 5-chloro-6-[(3S)-3-methyl-4-(m-t…

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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) 3.31 4.83 -11.31 2 7 0 89 420.922 3 ↓

Analogs

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Popular Name: 5-chloro-6-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-benzimidazol-2-one 5-chloro-6-[4-(4-methoxyphenyl)p…

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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 2.85 -14.01 2 8 0 99 422.894 4 ↓

Analogs

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Popular Name: 5-chloro-6-(4-phenylpiperazin-1-yl)sulfonyl-benzimidazol-2-one 5-chloro-6-(4-phenylpiperazin-1-…

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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) 2.56 3.56 -12.38 2 7 0 89 392.868 3 ↓

Analogs

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Popular Name: 5-chloro-6-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonyl-benzimidazol-2-one 5-chloro-6-[4-[3-(trifluoromethy…

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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) 3.43 4.58 -13.56 2 7 0 89 460.865 4 ↓

Analogs

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Popular Name: 5-chloro-6-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-benzimidazol-2-one 5-chloro-6-[4-(4-fluorophenyl)pi…

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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) 2.72 3.63 -13.73 2 7 0 89 410.858 3 ↓

Analogs

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Popular Name: 5-bromo-6-[4-(3-methoxyphenyl)piperazin-1-yl]sulfonyl-benzimidazol-2-one 5-bromo-6-[4-(3-methoxyphenyl)pi…

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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) 2.72 3.02 -13.75 2 8 0 99 467.345 4 ↓

Analogs

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Popular Name: 5-bromo-6-[(3S)-3-methyl-4-(m-tolyl)piperazin-1-yl]sulfonyl-benzimidazol-2-one 5-bromo-6-[(3S)-3-methyl-4-(m-to…

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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) 3.44 4.93 -11.11 2 7 0 89 465.373 3 ↓

Parameters Provided:

ring.id = 372552
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 = 372552 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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