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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: N-[(2S)-2-amino-2-phenyl-ethyl]-1,2,5-thiadiazole-3-carboxamide N-[(2S)-2-amino-2-phenyl-ethyl]-…

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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) -0.92 0.76 -49.86 4 5 1 83 249.319 4 ↓
Mid Mid (pH 6-8) -0.92 0.31 -5.34 3 5 0 81 248.311 4 ↓

Analogs

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Popular Name: N-[(2R)-2-amino-2-phenyl-ethyl]-1,2,5-thiadiazole-3-carboxamide N-[(2R)-2-amino-2-phenyl-ethyl]-…

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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) -0.92 0.76 -49.86 4 5 1 83 249.319 4 ↓
Mid Mid (pH 6-8) -0.92 0.4 -5.85 3 5 0 81 248.311 4 ↓

Analogs

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Popular Name: N-[(1S)-2-(4-chlorophenyl)-1-methyl-ethyl]-1,2,5-thiadiazole-3-carboxamide N-[(1S)-2-(4-chlorophenyl)-1-met…

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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 4.7 -6.78 1 4 0 55 281.768 4 ↓

Analogs

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Popular Name: N-[(1R)-2-(4-chlorophenyl)-1-methyl-ethyl]-1,2,5-thiadiazole-3-carboxamide N-[(1R)-2-(4-chlorophenyl)-1-met…

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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 4.69 -6.75 1 4 0 55 281.768 4 ↓

Analogs

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Popular Name: N-[2-(3-methoxyphenyl)ethyl]-1,2,5-thiadiazole-3-carboxamide N-[2-(3-methoxyphenyl)ethyl]-1,2…

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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) 1.80 2.45 -7.46 1 5 0 64 263.322 5 ↓

Analogs

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Popular Name: N-[(1S)-2-(3-chlorophenyl)-1-methyl-ethyl]-1,2,5-thiadiazole-3-carboxamide N-[(1S)-2-(3-chlorophenyl)-1-met…

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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) 2.75 4.69 -6.84 1 4 0 55 281.768 4 ↓

Analogs

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Popular Name: N-[(1R)-2-(3-chlorophenyl)-1-methyl-ethyl]-1,2,5-thiadiazole-3-carboxamide N-[(1R)-2-(3-chlorophenyl)-1-met…

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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) 2.75 4.69 -6.4 1 4 0 55 281.768 4 ↓

Analogs

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Popular Name: N-[2-(2,4,6-trimethylphenyl)ethyl]-1,2,5-thiadiazole-3-carboxamide N-[2-(2,4,6-trimethylphenyl)ethy…

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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) 2.97 4.87 -6.09 1 4 0 55 275.377 4 ↓

Analogs

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Popular Name: N-[(2R)-2-methoxy-2-phenyl-ethyl]-1,2,5-thiadiazole-3-carboxamide N-[(2R)-2-methoxy-2-phenyl-ethyl…

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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) 1.53 2.32 -6.06 1 5 0 64 263.322 5 ↓

Analogs

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Popular Name: N-[(2S)-2-methoxy-2-phenyl-ethyl]-1,2,5-thiadiazole-3-carboxamide N-[(2S)-2-methoxy-2-phenyl-ethyl…

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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) 1.53 2.23 -6.11 1 5 0 64 263.322 5 ↓

Analogs

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Popular Name: N-[2-(4-nitrophenyl)ethyl]-1,2,5-thiadiazole-3-carboxamide N-[2-(4-nitrophenyl)ethyl]-1,2,5…

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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) 1.73 3.86 -11.53 1 7 0 101 278.293 5 ↓

Analogs

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Popular Name: N-[2-(2,6-dichlorophenyl)ethyl]-1,2,5-thiadiazole-3-carboxamide N-[2-(2,6-dichlorophenyl)ethyl]-…

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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) 3.03 4 -5.74 1 4 0 55 302.186 4 ↓

Analogs

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Popular Name: N-[2-(4-hydroxyphenyl)ethyl]-1,2,5-thiadiazole-3-carboxamide N-[2-(4-hydroxyphenyl)ethyl]-1,2…

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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) 1.29 0.3 -8.02 2 5 0 75 249.295 4 ↓

Analogs

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Popular Name: N-[2-(3,5-dichlorophenyl)ethyl]-1,2,5-thiadiazole-3-carboxamide N-[2-(3,5-dichlorophenyl)ethyl]-…

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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) 3.05 4.16 -6.34 1 4 0 55 302.186 4 ↓

Analogs

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Popular Name: N-[(2S)-2-(3-fluorophenyl)-2-hydroxy-ethyl]-1,2,5-thiadiazole-3-carboxamide N-[(2S)-2-(3-fluorophenyl)-2-hyd…

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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) 0.92 0.06 -7.54 2 5 0 75 267.285 4 ↓

Analogs

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Popular Name: N-[(2R)-2-(3-fluorophenyl)-2-hydroxy-ethyl]-1,2,5-thiadiazole-3-carboxamide N-[(2R)-2-(3-fluorophenyl)-2-hyd…

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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) 0.92 0.13 -7.5 2 5 0 75 267.285 4 ↓

Analogs

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Popular Name: N-[2-(2,3-dichlorophenyl)ethyl]-1,2,5-thiadiazole-3-carboxamide N-[2-(2,3-dichlorophenyl)ethyl]-…

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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) 3.03 3.98 -7.57 1 4 0 55 302.186 4 ↓

Analogs

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Popular Name: N-[(1S)-2-(2-chlorophenyl)-1-methyl-ethyl]-1,2,5-thiadiazole-3-carboxamide N-[(1S)-2-(2-chlorophenyl)-1-met…

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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) 2.73 4.53 -6.48 1 4 0 55 281.768 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R)-2-(2-chlorophenyl)-1-methyl-ethyl]-1,2,5-thiadiazole-3-carboxamide N-[(1R)-2-(2-chlorophenyl)-1-met…

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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) 2.73 4.53 -6.57 1 4 0 55 281.768 4 ↓

Analogs

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Popular Name: N-[(1R)-1-methyl-2-(o-tolyl)ethyl]-1,2,5-thiadiazole-3-carboxamide N-[(1R)-1-methyl-2-(o-tolyl)ethy…

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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) 2.50 4.51 -6.15 1 4 0 55 261.35 4 ↓

Analogs

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Popular Name: N-[(1S)-1-methyl-2-(o-tolyl)ethyl]-1,2,5-thiadiazole-3-carboxamide N-[(1S)-1-methyl-2-(o-tolyl)ethy…

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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) 2.50 4.56 -6.06 1 4 0 55 261.35 4 ↓

Analogs

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Popular Name: N-[2-(2,5-dimethoxyphenyl)ethyl]-1,2,5-thiadiazole-3-carboxamide N-[2-(2,5-dimethoxyphenyl)ethyl]…

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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) 1.81 1.78 -7.93 1 6 0 73 293.348 6 ↓

Analogs

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Popular Name: N-[(2S)-2-(dimethylamino)-2-(p-tolyl)ethyl]-1,2,5-thiadiazole-3-carboxamide N-[(2S)-2-(dimethylamino)-2-(p-t…

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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) 2.02 4.93 -40.34 2 5 1 59 291.4 5 ↓
Hi High (pH 8-9.5) 2.02 2.7 -4.48 1 5 0 58 290.392 5 ↓

Analogs

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Popular Name: N-[(2R)-2-(dimethylamino)-2-(p-tolyl)ethyl]-1,2,5-thiadiazole-3-carboxamide N-[(2R)-2-(dimethylamino)-2-(p-t…

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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) 2.02 4.94 -40.68 2 5 1 59 291.4 5 ↓
Hi High (pH 8-9.5) 2.02 2.91 -5.04 1 5 0 58 290.392 5 ↓

Parameters Provided:

ring.id = 286395
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 = 286395 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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