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

Analogs

40767996
40767996
40767998
40767998
40768000
40768000
68688656
68688656
68688657
68688657

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2R)-2-[2-(azepan-1-yl)ethylcarbamoyl]cyclopropanecarboxylic (1S,2R)-2-[2-(azepan-1-yl)ethylc…

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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) 1.21 6.35 -59.19 2 5 0 74 254.33 5 ↓
Lo Low (pH 4.5-6) 1.21 4.41 -46.57 3 5 1 71 255.338 5 ↓

Analogs

40767998
40767998
40768000
40768000
68688656
68688656
68688657
68688657
68688658
68688658

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2S)-2-[2-(azepan-1-yl)ethylcarbamoyl]cyclopropanecarboxylic (1S,2S)-2-[2-(azepan-1-yl)ethylc…

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) 1.21 6.43 -68.65 2 5 0 74 254.33 5 ↓
Lo Low (pH 4.5-6) 1.21 4.44 -42.8 3 5 1 71 255.338 5 ↓

Analogs

40768000
40768000
68688656
68688656
68688657
68688657
68688658
68688658
68688659
68688659

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2R)-2-[2-(azepan-1-yl)ethylcarbamoyl]cyclopropanecarboxylic (1R,2R)-2-[2-(azepan-1-yl)ethylc…

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) 1.21 6.44 -69.49 2 5 0 74 254.33 5 ↓
Lo Low (pH 4.5-6) 1.21 4.44 -42.92 3 5 1 71 255.338 5 ↓

Analogs

68688656
68688656
68688657
68688657
68688658
68688658
68688659
68688659
40767994
40767994

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2S)-2-[2-(azepan-1-yl)ethylcarbamoyl]cyclopropanecarboxylic (1R,2S)-2-[2-(azepan-1-yl)ethylc…

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) 1.21 6.35 -58.94 2 5 0 74 254.33 5 ↓
Lo Low (pH 4.5-6) 1.21 4.4 -46.39 3 5 1 71 255.338 5 ↓

Parameters Provided:

ring.id = 517049
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 = 517049 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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