UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 1-(ethylcarbamoylamino)-N-[(1-methylcyclopentyl)methyl]cyclopentanecarboxamide 1-(ethylcarbamoylamino)-N-[(1-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) 2.73 4.37 -15.38 3 5 0 70 295.427 5 ↓

Analogs

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Popular Name: N-(cyclopentylmethyl)-1-(ethylcarbamoylamino)-N-methyl-cyclopentanecarboxamide N-(cyclopentylmethyl)-1-(ethylca…

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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 5.72 -16 2 5 0 61 295.427 5 ↓

Analogs

44822405
44822405
44822406
44822406
44824585
44824585
44824678
44824678
44824681
44824681

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Popular Name: 1-cyano-N-(cyclopentylmethyl)-N-methyl-cyclopentanecarboxamide 1-cyano-N-(cyclopentylmethyl)-N-…

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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) 2.71 7.42 -6.27 0 3 0 44 234.343 3 ↓

Analogs

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Popular Name: 1-amino-N-[(1S)-1-cyclopentylethyl]cyclopentanecarboxamide 1-amino-N-[(1S)-1-cyclopentyleth…

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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) 2.41 4.2 -50.97 4 3 1 57 225.356 3 ↓
Hi High (pH 8-9.5) 2.41 3.97 -6.33 3 3 0 55 224.348 3 ↓

Analogs

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Popular Name: 1-amino-N-[(1R)-1-cyclopentylethyl]cyclopentanecarboxamide 1-amino-N-[(1R)-1-cyclopentyleth…

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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) 2.41 3.98 -51.66 4 3 1 57 225.356 3 ↓
Hi High (pH 8-9.5) 2.41 3.75 -6.33 3 3 0 55 224.348 3 ↓

Analogs

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Popular Name: 1-cyano-N-[(1S)-1-cyclopentylethyl]cyclopentanecarboxamide 1-cyano-N-[(1S)-1-cyclopentyleth…

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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) 3.13 6.88 -6.18 1 3 0 53 234.343 3 ↓

Analogs

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Popular Name: 1-cyano-N-[(1R)-1-cyclopentylethyl]cyclopentanecarboxamide 1-cyano-N-[(1R)-1-cyclopentyleth…

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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) 3.13 6.66 -6.43 1 3 0 53 234.343 3 ↓

Analogs

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Popular Name: 1-carbamothioyl-N-[(1S)-1-cyclopentylethyl]cyclopentanecarboxamide 1-carbamothioyl-N-[(1S)-1-cyclop…

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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) 2.26 5.51 -5.28 3 3 0 55 268.426 4 ↓

Analogs

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Popular Name: 1-carbamothioyl-N-[(1R)-1-cyclopentylethyl]cyclopentanecarboxamide 1-carbamothioyl-N-[(1R)-1-cyclop…

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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) 2.26 5.35 -5.52 3 3 0 55 268.426 4 ↓

Parameters Provided:

ring.id = 140747
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 = 140747 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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