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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(1S,3R)-3-methoxycyclohexyl]azetidin-3-ol 1-[(1S,3R)-3-methoxycyclohexyl]a…

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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) 0.70 1.94 -34.32 2 3 1 34 186.275 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(1S,3S)-3-methoxycyclohexyl]azetidin-3-ol 1-[(1S,3S)-3-methoxycyclohexyl]a…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.70 2.08 -30.79 2 3 1 34 186.275 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(1R,3R)-3-methoxycyclohexyl]azetidin-3-ol 1-[(1R,3R)-3-methoxycyclohexyl]a…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.70 2.08 -30.76 2 3 1 34 186.275 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(1R,3S)-3-methoxycyclohexyl]azetidin-3-ol 1-[(1R,3S)-3-methoxycyclohexyl]a…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.70 1.94 -34.63 2 3 1 34 186.275 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(1S,3R)-3-methoxycyclohexyl]azetidin-3-amine 1-[(1S,3R)-3-methoxycyclohexyl]a…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.20 -0.5 -45.83 3 3 1 40 185.291 2 ↓
Hi High (pH 8-9.5) 0.20 -0.83 -2.86 2 3 0 38 184.283 2 ↓
Lo Low (pH 4.5-6) 0.20 2.31 -33.49 3 3 1 40 185.291 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(1S,3S)-3-methoxycyclohexyl]azetidin-3-amine 1-[(1S,3S)-3-methoxycyclohexyl]a…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.20 -0.37 -41.91 3 3 1 40 185.291 2 ↓
Hi High (pH 8-9.5) 0.20 -0.68 -2.12 2 3 0 38 184.283 2 ↓
Lo Low (pH 4.5-6) 0.20 2.45 -31.18 3 3 1 40 185.291 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(1R,3R)-3-methoxycyclohexyl]azetidin-3-amine 1-[(1R,3R)-3-methoxycyclohexyl]a…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.20 -0.2 -40.25 3 3 1 40 185.291 2 ↓
Hi High (pH 8-9.5) 0.20 -0.66 -2.52 2 3 0 38 184.283 2 ↓
Lo Low (pH 4.5-6) 0.20 2.47 -28.57 3 3 1 40 185.291 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(1R,3S)-3-methoxycyclohexyl]azetidin-3-amine 1-[(1R,3S)-3-methoxycyclohexyl]a…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.20 -0.34 -41.6 3 3 1 40 185.291 2 ↓
Hi High (pH 8-9.5) 0.20 -0.8 -3.63 2 3 0 38 184.283 2 ↓
Lo Low (pH 4.5-6) 0.20 2.33 -31.84 3 3 1 40 185.291 2 ↓

Parameters Provided:

ring.id = 479757
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 = 479757 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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