UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

26515137
26515137
26515139
26515139
26515141
26515141
26515143
26515143
26515145
26515145

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Popular Name: 4-[(4-methylcyclohexyl)oxy]piperidine hydrochloride 4-[(4-methylcyclohexyl)oxy]piper…

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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) 1.07 5.48 -40.24 2 2 1 26 198.33 2 ↓

Analogs

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Popular Name: 4-(4-methylcyclohexoxy)-1-propylsulfonyl-piperidine 4-(4-methylcyclohexoxy)-1-propyl…

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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) 1.92 6.27 -10.9 0 4 0 47 303.468 5 ↓

Analogs

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Popular Name: 4-[(1S,3R)-3-methoxycyclohexoxy]piperidine 4-[(1S,3R)-3-methoxycyclohexoxy]…

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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) 0.53 3.93 -41.16 2 3 1 35 214.329 3 ↓

Analogs

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Popular Name: 4-[(1S,3S)-3-methoxycyclohexoxy]piperidine 4-[(1S,3S)-3-methoxycyclohexoxy]…

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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) 0.53 4.27 -40.19 2 3 1 35 214.329 3 ↓

Analogs

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Popular Name: 4-[(1R,3R)-3-methoxycyclohexoxy]piperidine 4-[(1R,3R)-3-methoxycyclohexoxy]…

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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) 0.53 4.27 -38.09 2 3 1 35 214.329 3 ↓

Analogs

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Popular Name: 4-[(1R,3S)-3-methoxycyclohexoxy]piperidine 4-[(1R,3S)-3-methoxycyclohexoxy]…

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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) 0.53 4.12 -40.86 2 3 1 35 214.329 3 ↓

Analogs

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Popular Name: N-butyl-N-methyl-4-(4-methylcyclohexoxy)piperidine-1-sulfonamide N-butyl-N-methyl-4-(4-methylcycl…

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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) 2.48 7.25 -9.02 0 5 0 50 346.537 7 ↓

Analogs

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Popular Name: 4-(4-methylcyclohexoxy)-1-methylsulfonyl-piperidine 4-(4-methylcyclohexoxy)-1-methyl…

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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) 1.04 4.53 -11.41 0 4 0 47 275.414 3 ↓

Parameters Provided:

ring.id = 48270
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 = 48270 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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