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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: (4R)-N-cyclopropyl-6-propyl-chroman-4-amine (4R)-N-cyclopropyl-6-propyl-chro…

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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) 2.56 7.94 -37.36 2 2 1 26 232.347 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-N-cyclopropyl-6-propyl-chroman-4-amine (4S)-N-cyclopropyl-6-propyl-chro…

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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) 2.56 7.96 -37.57 2 2 1 26 232.347 4 ↓

Analogs

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Popular Name: (4R)-N-cyclopropyl-7,8-difluoro-chroman-4-amine (4R)-N-cyclopropyl-7,8-difluoro-…

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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) 1.51 5.86 -48.89 2 2 1 26 226.246 2 ↓
Hi High (pH 8-9.5) 1.51 4.38 -6.67 1 2 0 21 225.238 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-N-cyclopropyl-7,8-difluoro-chroman-4-amine (4S)-N-cyclopropyl-7,8-difluoro-…

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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) 1.51 5.89 -49.2 2 2 1 26 226.246 2 ↓
Hi High (pH 8-9.5) 1.51 4.4 -5.75 1 2 0 21 225.238 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-N-cyclopropyl-5,7-difluoro-chroman-4-amine (4S)-N-cyclopropyl-5,7-difluoro-…

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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) 1.51 5.96 -33.68 2 2 1 26 226.246 2 ↓
Hi High (pH 8-9.5) 1.51 4.89 -3.42 1 2 0 21 225.238 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-N-cyclopropyl-5,7-difluoro-chroman-4-amine (4R)-N-cyclopropyl-5,7-difluoro-…

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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) 1.51 5.96 -33.69 2 2 1 26 226.246 2 ↓
Hi High (pH 8-9.5) 1.51 5.3 -3.32 1 2 0 21 225.238 2 ↓

Analogs

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Popular Name: (4S)-5-bromo-8-chloro-N-cyclopropyl-chroman-4-amine (4S)-5-bromo-8-chloro-N-cyclopro…

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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) 2.67 7.09 -31.12 2 2 1 26 303.607 2 ↓
Hi High (pH 8-9.5) 2.67 6.44 -3.28 1 2 0 21 302.599 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-5-bromo-8-chloro-N-cyclopropyl-chroman-4-amine (4R)-5-bromo-8-chloro-N-cyclopro…

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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) 2.67 7.09 -31.11 2 2 1 26 303.607 2 ↓
Hi High (pH 8-9.5) 2.67 6.87 -3.11 1 2 0 21 302.599 2 ↓

Analogs

37870018
37870018
37870019
37870019
37870291
37870291
37870292
37870292

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-4-(cyclopropylamino)chromane-4-carboxylic (4S)-4-(cyclopropylamino)chroman…

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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) 1.50 5.88 -32.92 2 4 0 66 233.267 3 ↓

Analogs

37870018
37870018
37870019
37870019
37870291
37870291
37870292
37870292

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-4-(cyclopropylamino)chromane-4-carboxylic (4R)-4-(cyclopropylamino)chroman…

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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) 1.50 5.71 -33.14 2 4 0 66 233.267 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(4S)-4-(cyclopropylamino)chroman-4-yl]methanol [(4S)-4-(cyclopropylamino)chroma…

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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) 1.62 2.62 -37.27 3 3 1 46 220.292 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(4R)-4-(cyclopropylamino)chroman-4-yl]methanol [(4R)-4-(cyclopropylamino)chroma…

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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) 1.62 2.66 -37.17 3 3 1 46 220.292 3 ↓

Parameters Provided:

ring.id = 43919
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 = 43919 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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