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

Analogs

37304909
37304909
37304910
37304910
44317341
44317341
44317342
44317342
30908730
30908730

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Popular Name: (4R)-N-[(5-bromo-2-furyl)methyl]-1-methyl-4,5,6,7-tetrahydroindazol-4-amine (4R)-N-[(5-bromo-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) 1.56 6.31 -45.4 2 4 1 48 311.203 3 ↓
Hi High (pH 8-9.5) 1.56 4.92 -7.39 1 4 0 43 310.195 3 ↓

Analogs

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Popular Name: (4S)-N-[(5-bromo-2-furyl)methyl]-1-methyl-4,5,6,7-tetrahydroindazol-4-amine (4S)-N-[(5-bromo-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) 1.56 6.34 -45.31 2 4 1 48 311.203 3 ↓
Hi High (pH 8-9.5) 1.56 4.94 -7.46 1 4 0 43 310.195 3 ↓

Analogs

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Popular Name: (4R)-1-methyl-N-[(5-nitro-2-furyl)methyl]-4,5,6,7-tetrahydroindazol-4-amine (4R)-1-methyl-N-[(5-nitro-2-fury…

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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) 0.71 4.89 -10.84 1 7 0 89 276.296 4 ↓
Mid Mid (pH 6-8) 0.71 6.29 -57.57 2 7 1 93 277.304 4 ↓

Analogs

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Popular Name: (4S)-1-methyl-N-[(5-nitro-2-furyl)methyl]-4,5,6,7-tetrahydroindazol-4-amine (4S)-1-methyl-N-[(5-nitro-2-fury…

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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) 0.71 4.91 -12.25 1 7 0 89 276.296 4 ↓
Mid Mid (pH 6-8) 0.71 6.31 -57.26 2 7 1 93 277.304 4 ↓

Analogs

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Popular Name: (4R)-N-[(5-iodo-2-furyl)methyl]-1-methyl-4,5,6,7-tetrahydroindazol-4-amine (4R)-N-[(5-iodo-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) 1.84 6.78 -45.01 2 4 1 48 358.203 3 ↓
Hi High (pH 8-9.5) 1.84 5.39 -7.23 1 4 0 43 357.195 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-N-[(5-iodo-2-furyl)methyl]-1-methyl-4,5,6,7-tetrahydroindazol-4-amine (4S)-N-[(5-iodo-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) 1.84 6.81 -44.92 2 4 1 48 358.203 3 ↓
Hi High (pH 8-9.5) 1.84 5.41 -7.09 1 4 0 43 357.195 3 ↓

Analogs

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Popular Name: methyl 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) 0.70 6.38 -52.03 2 6 1 74 290.343 5 ↓
Mid Mid (pH 6-8) 0.70 4.99 -10.44 1 6 0 69 289.335 5 ↓

Analogs

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Popular Name: methyl 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) 0.70 6.41 -51.88 2 6 1 74 290.343 5 ↓
Mid Mid (pH 6-8) 0.70 5.01 -10.48 1 6 0 69 289.335 5 ↓

Analogs

30908868
30908868
30908869
30908869
30908870
30908870
30908871
30908871
37087262
37087262

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-1-methyl-N-[[5-(methylsulfanylmethyl)-2-furyl]methyl]-4,5,6,7-tetrahydroindazol-4-amine (4R)-1-methyl-N-[[5-(methylsulfa…

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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) 1.37 7.63 -44.39 2 4 1 48 292.428 5 ↓
Hi High (pH 8-9.5) 1.37 6.24 -9.56 1 4 0 43 291.42 5 ↓

Analogs

30908868
30908868
30908869
30908869
30908870
30908870
30908871
30908871
37087262
37087262

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-1-methyl-N-[[5-(methylsulfanylmethyl)-2-furyl]methyl]-4,5,6,7-tetrahydroindazol-4-amine (4S)-1-methyl-N-[[5-(methylsulfa…

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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) 1.37 7.65 -44.33 2 4 1 48 292.428 5 ↓
Hi High (pH 8-9.5) 1.37 6.26 -9.15 1 4 0 43 291.42 5 ↓

Analogs

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Popular Name: 2-[(4R)-4-[(5-iodo-2-furyl)methylamino]-4,5,6,7-tetrahydroindazol-1-yl]ethanol 2-[(4R)-4-[(5-iodo-2-furyl)methy…

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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 4.3 -47.2 3 5 1 68 388.229 5 ↓
Hi High (pH 8-9.5) 1.21 2.9 -7.29 2 5 0 63 387.221 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4S)-4-[(5-iodo-2-furyl)methylamino]-4,5,6,7-tetrahydroindazol-1-yl]ethanol 2-[(4S)-4-[(5-iodo-2-furyl)methy…

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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 4.29 -47.17 3 5 1 68 388.229 5 ↓
Hi High (pH 8-9.5) 1.21 2.9 -9.34 2 5 0 63 387.221 5 ↓

Parameters Provided:

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Structural Results Found: (before additional filtering)

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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 = 141724 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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