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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

44911159
44911159
44911162
44911162
44911165
44911165
44911167
44911167

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-N-[(1R,2S)-2-imidazol-1-ylcyclopentyl]thiochroman-4-amine (4R)-N-[(1R,2S)-2-imidazol-1-ylc…

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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) 1.86 10.9 -42.71 2 3 1 34 300.451 3 ↓
Hi High (pH 8-9.5) 1.86 10.56 -7.12 1 3 0 30 299.443 3 ↓
Mid Mid (pH 6-8) 1.86 12.05 -108.96 3 3 2 36 301.459 3 ↓

Analogs

44911159
44911159
44911162
44911162
44911165
44911165
44911167
44911167

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-N-[(1R,2S)-2-imidazol-1-ylcyclopentyl]thiochroman-4-amine (4S)-N-[(1R,2S)-2-imidazol-1-ylc…

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) 1.86 10.83 -42.14 2 3 1 34 300.451 3 ↓
Hi High (pH 8-9.5) 1.86 10.07 -7.13 1 3 0 30 299.443 3 ↓
Mid Mid (pH 6-8) 1.86 11.97 -109.78 3 3 2 36 301.459 3 ↓

Analogs

44911159
44911159
44911162
44911162
44911165
44911165
44911167
44911167

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-N-[(1S,2S)-2-imidazol-1-ylcyclopentyl]thiochroman-4-amine (4R)-N-[(1S,2S)-2-imidazol-1-ylc…

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) 1.86 10.37 -51.23 2 3 1 34 300.451 3 ↓
Hi High (pH 8-9.5) 1.86 9.77 -7.76 1 3 0 30 299.443 3 ↓
Mid Mid (pH 6-8) 1.86 11.11 -112.35 3 3 2 36 301.459 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-N-[(1S,2S)-2-imidazol-1-ylcyclopentyl]thiochroman-4-amine (4S)-N-[(1S,2S)-2-imidazol-1-ylc…

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) 1.86 10.54 -51.44 2 3 1 34 300.451 3 ↓
Hi High (pH 8-9.5) 1.86 9.48 -7.55 1 3 0 30 299.443 3 ↓
Mid Mid (pH 6-8) 1.86 11.28 -109.67 3 3 2 36 301.459 3 ↓

Parameters Provided:

ring.id = 150330
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 = 150330 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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