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

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Popular Name: (4R)-6-bromo-N-(2-furylmethyl)chroman-4-amine (4R)-6-bromo-N-(2-furylmethyl)ch…

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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) 2.36 6.76 -44.06 2 3 1 39 309.183 3 ↓

Analogs

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Popular Name: (4S)-6-bromo-N-(2-furylmethyl)chroman-4-amine (4S)-6-bromo-N-(2-furylmethyl)ch…

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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) 2.36 6.77 -43.74 2 3 1 39 309.183 3 ↓

Analogs

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Popular Name: (4R)-N-(2-furylmethyl)-6-methoxy-chroman-4-amine (4R)-N-(2-furylmethyl)-6-methoxy…

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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) 1.61 5.42 -42.91 2 4 1 48 260.313 4 ↓

Analogs

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Popular Name: (4S)-N-(2-furylmethyl)-6-methoxy-chroman-4-amine (4S)-N-(2-furylmethyl)-6-methoxy…

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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) 1.61 5.42 -42.61 2 4 1 48 260.313 4 ↓

Analogs

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Popular Name: (4R)-6,8-dichloro-N-(2-furylmethyl)chroman-4-amine (4R)-6,8-dichloro-N-(2-furylmeth…

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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) 2.83 7.22 -48.3 2 3 1 39 299.177 3 ↓
Hi High (pH 8-9.5) 2.83 5.99 -6.18 1 3 0 34 298.169 3 ↓

Analogs

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Popular Name: (4S)-6,8-dichloro-N-(2-furylmethyl)chroman-4-amine (4S)-6,8-dichloro-N-(2-furylmeth…

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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) 2.83 7.22 -47.86 2 3 1 39 299.177 3 ↓
Hi High (pH 8-9.5) 2.83 6.24 -6.04 1 3 0 34 298.169 3 ↓

Analogs

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Popular Name: (4R)-6-bromo-N-[(1R)-1-(5-methyl-2-furyl)ethyl]chroman-4-amine (4R)-6-bromo-N-[(1R)-1-(5-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) 3.14 8.07 -39.69 2 3 1 39 337.237 3 ↓

Analogs

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Popular Name: (4R)-6-bromo-N-[(1S)-1-(5-methyl-2-furyl)ethyl]chroman-4-amine (4R)-6-bromo-N-[(1S)-1-(5-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) 3.14 7.45 -39.49 2 3 1 39 337.237 3 ↓

Analogs

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Popular Name: (4S)-6-bromo-N-[(1R)-1-(5-methyl-2-furyl)ethyl]chroman-4-amine (4S)-6-bromo-N-[(1R)-1-(5-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) 3.14 7.45 -39.47 2 3 1 39 337.237 3 ↓

Analogs

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Popular Name: (4S)-6-bromo-N-[(1S)-1-(5-methyl-2-furyl)ethyl]chroman-4-amine (4S)-6-bromo-N-[(1S)-1-(5-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) 3.14 8.1 -39.79 2 3 1 39 337.237 3 ↓

Analogs

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Popular Name: (4R)-6-methoxy-N-[(1R)-1-(5-methyl-2-furyl)ethyl]chroman-4-amine (4R)-6-methoxy-N-[(1R)-1-(5-meth…

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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) 2.39 6.73 -38.61 2 4 1 48 288.367 4 ↓

Analogs

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Popular Name: (4R)-6-methoxy-N-[(1S)-1-(5-methyl-2-furyl)ethyl]chroman-4-amine (4R)-6-methoxy-N-[(1S)-1-(5-meth…

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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) 2.39 6.12 -38.3 2 4 1 48 288.367 4 ↓

Analogs

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Popular Name: (4S)-6-methoxy-N-[(1R)-1-(5-methyl-2-furyl)ethyl]chroman-4-amine (4S)-6-methoxy-N-[(1R)-1-(5-meth…

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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) 2.39 6.11 -38.3 2 4 1 48 288.367 4 ↓

Analogs

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Popular Name: (4S)-6-methoxy-N-[(1S)-1-(5-methyl-2-furyl)ethyl]chroman-4-amine (4S)-6-methoxy-N-[(1S)-1-(5-meth…

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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) 2.39 6.75 -38.66 2 4 1 48 288.367 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-6,8-dichloro-N-[(1R)-1-(5-methyl-2-furyl)ethyl]chroman-4-amine (4R)-6,8-dichloro-N-[(1R)-1-(5-m…

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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) 3.62 8.53 -43.51 2 3 1 39 327.231 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-6,8-dichloro-N-[(1S)-1-(5-methyl-2-furyl)ethyl]chroman-4-amine (4R)-6,8-dichloro-N-[(1S)-1-(5-m…

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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) 3.62 7.91 -43.39 2 3 1 39 327.231 3 ↓

Analogs

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Popular Name: (4S)-6,8-dichloro-N-[(1R)-1-(5-methyl-2-furyl)ethyl]chroman-4-amine (4S)-6,8-dichloro-N-[(1R)-1-(5-m…

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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) 3.62 7.9 -43.4 2 3 1 39 327.231 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-6,8-dichloro-N-[(1S)-1-(5-methyl-2-furyl)ethyl]chroman-4-amine (4S)-6,8-dichloro-N-[(1S)-1-(5-m…

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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) 3.62 8.54 -43.6 2 3 1 39 327.231 3 ↓

Analogs

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Popular Name: (4R)-N-[(5-nitro-2-furyl)methyl]chroman-4-amine (4R)-N-[(5-nitro-2-furyl)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) 1.66 6.86 -60.03 2 6 1 85 275.284 4 ↓

Analogs

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Popular Name: (4S)-N-[(5-nitro-2-furyl)methyl]chroman-4-amine (4S)-N-[(5-nitro-2-furyl)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) 1.66 6.86 -57.99 2 6 1 85 275.284 4 ↓

Analogs

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Popular Name: (4R)-N-[(5-iodo-2-furyl)methyl]chroman-4-amine (4R)-N-[(5-iodo-2-furyl)methyl]c…

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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) 2.78 7.36 -46.67 2 3 1 39 356.183 3 ↓

Analogs

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Popular Name: (4S)-N-[(5-iodo-2-furyl)methyl]chroman-4-amine (4S)-N-[(5-iodo-2-furyl)methyl]c…

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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) 2.78 7.36 -45.59 2 3 1 39 356.183 3 ↓

Analogs

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Popular Name: (4R)-N-[[5-(methylsulfanylmethyl)-2-furyl]methyl]chroman-4-amine (4R)-N-[[5-(methylsulfanylmethyl…

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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) 2.31 8.21 -45.89 2 3 1 39 290.408 5 ↓

Analogs

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Popular Name: (4S)-N-[[5-(methylsulfanylmethyl)-2-furyl]methyl]chroman-4-amine (4S)-N-[[5-(methylsulfanylmethyl…

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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) 2.31 8.21 -45.1 2 3 1 39 290.408 5 ↓

Parameters Provided:

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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 = 467180 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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