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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: 5-chloro-4-[[(1S,3R)-3-methylcyclohexyl]sulfanylmethyl]thiadiazole 5-chloro-4-[[(1S,3R)-3-methylcyc…

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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) 3.98 7.21 -3.76 0 2 0 26 262.831 3 ↓

Analogs

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Popular Name: 5-chloro-4-[[(1S,3S)-3-methylcyclohexyl]sulfanylmethyl]thiadiazole 5-chloro-4-[[(1S,3S)-3-methylcyc…

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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) 3.98 6.98 -3.79 0 2 0 26 262.831 3 ↓

Analogs

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Popular Name: 5-chloro-4-[[(1R,3R)-3-methylcyclohexyl]sulfanylmethyl]thiadiazole 5-chloro-4-[[(1R,3R)-3-methylcyc…

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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) 3.98 6.98 -3.84 0 2 0 26 262.831 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-chloro-4-[[(1R,3S)-3-methylcyclohexyl]sulfanylmethyl]thiadiazole 5-chloro-4-[[(1R,3S)-3-methylcyc…

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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) 3.98 7.21 -3.83 0 2 0 26 262.831 3 ↓

Analogs

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Popular Name: 4-[[(1S,3R)-3-methylcyclohexyl]sulfanylmethyl]thiadiazol-5-amine 4-[[(1S,3R)-3-methylcyclohexyl]s…

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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 4.6 -7.96 2 3 0 52 243.401 3 ↓

Analogs

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Popular Name: 4-[[(1S,3S)-3-methylcyclohexyl]sulfanylmethyl]thiadiazol-5-amine 4-[[(1S,3S)-3-methylcyclohexyl]s…

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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 4.38 -7.99 2 3 0 52 243.401 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[(1R,3R)-3-methylcyclohexyl]sulfanylmethyl]thiadiazol-5-amine 4-[[(1R,3R)-3-methylcyclohexyl]s…

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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 4.38 -8.04 2 3 0 52 243.401 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[(1R,3S)-3-methylcyclohexyl]sulfanylmethyl]thiadiazol-5-amine 4-[[(1R,3S)-3-methylcyclohexyl]s…

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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 4.6 -8.07 2 3 0 52 243.401 3 ↓

Analogs

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Popular Name: N-methyl-4-[[(1S,3R)-3-methylcyclohexyl]sulfanylmethyl]thiadiazol-5-amine N-methyl-4-[[(1S,3R)-3-methylcyc…

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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) 3.16 5.64 -7.96 1 3 0 38 257.428 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-methyl-4-[[(1S,3S)-3-methylcyclohexyl]sulfanylmethyl]thiadiazol-5-amine N-methyl-4-[[(1S,3S)-3-methylcyc…

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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) 3.16 5.41 -7.97 1 3 0 38 257.428 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-methyl-4-[[(1R,3R)-3-methylcyclohexyl]sulfanylmethyl]thiadiazol-5-amine N-methyl-4-[[(1R,3R)-3-methylcyc…

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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) 3.16 5.41 -8.04 1 3 0 38 257.428 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-methyl-4-[[(1R,3S)-3-methylcyclohexyl]sulfanylmethyl]thiadiazol-5-amine N-methyl-4-[[(1R,3S)-3-methylcyc…

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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) 3.16 5.64 -8.01 1 3 0 38 257.428 4 ↓

Analogs

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Popular Name: N-ethyl-4-[[(1R,3S)-3-methylcyclohexyl]sulfanylmethyl]thiadiazol-5-amine N-ethyl-4-[[(1R,3S)-3-methylcycl…

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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) 3.53 6.47 -7.15 1 3 0 38 271.455 5 ↓

Analogs

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Popular Name: N-ethyl-4-[[(1S,3S)-3-methylcyclohexyl]sulfanylmethyl]thiadiazol-5-amine N-ethyl-4-[[(1S,3S)-3-methylcycl…

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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) 3.53 6.24 -7.21 1 3 0 38 271.455 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-ethyl-4-[[(1R,3R)-3-methylcyclohexyl]sulfanylmethyl]thiadiazol-5-amine N-ethyl-4-[[(1R,3R)-3-methylcycl…

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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) 3.53 6.24 -7.15 1 3 0 38 271.455 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-ethyl-4-[[(1S,3R)-3-methylcyclohexyl]sulfanylmethyl]thiadiazol-5-amine N-ethyl-4-[[(1S,3R)-3-methylcycl…

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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) 3.53 6.47 -7.26 1 3 0 38 271.455 5 ↓

Analogs

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Popular Name: 4-[[(1R,3S)-3-methylcyclohexyl]sulfanylmethyl]-N-propyl-thiadiazol-5-amine 4-[[(1R,3S)-3-methylcyclohexyl]s…

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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) 4.04 7.22 -6.83 1 3 0 38 285.482 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[(1S,3S)-3-methylcyclohexyl]sulfanylmethyl]-N-propyl-thiadiazol-5-amine 4-[[(1S,3S)-3-methylcyclohexyl]s…

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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) 4.04 6.99 -6.91 1 3 0 38 285.482 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[(1R,3R)-3-methylcyclohexyl]sulfanylmethyl]-N-propyl-thiadiazol-5-amine 4-[[(1R,3R)-3-methylcyclohexyl]s…

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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) 4.04 6.99 -6.89 1 3 0 38 285.482 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[(1S,3R)-3-methylcyclohexyl]sulfanylmethyl]-N-propyl-thiadiazol-5-amine 4-[[(1S,3R)-3-methylcyclohexyl]s…

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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) 4.04 7.22 -6.93 1 3 0 38 285.482 6 ↓

Analogs

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Popular Name: [4-[[(1S,3R)-3-methylcyclohexyl]sulfanylmethyl]thiadiazol-5-yl]hydrazine [4-[[(1S,3R)-3-methylcyclohexyl]…

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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) 2.54 4.4 -8.62 3 4 0 64 258.416 4 ↓
Lo Low (pH 4.5-6) 2.54 4.22 -56.03 4 4 1 65 259.424 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [4-[[(1S,3S)-3-methylcyclohexyl]sulfanylmethyl]thiadiazol-5-yl]hydrazine [4-[[(1S,3S)-3-methylcyclohexyl]…

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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) 2.54 4.17 -8.62 3 4 0 64 258.416 4 ↓
Lo Low (pH 4.5-6) 2.54 4 -56.05 4 4 1 65 259.424 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [4-[[(1R,3R)-3-methylcyclohexyl]sulfanylmethyl]thiadiazol-5-yl]hydrazine [4-[[(1R,3R)-3-methylcyclohexyl]…

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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) 2.54 4.17 -8.63 3 4 0 64 258.416 4 ↓
Lo Low (pH 4.5-6) 2.54 4 -56.56 4 4 1 65 259.424 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [4-[[(1R,3S)-3-methylcyclohexyl]sulfanylmethyl]thiadiazol-5-yl]hydrazine [4-[[(1R,3S)-3-methylcyclohexyl]…

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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) 2.54 4.4 -8.7 3 4 0 64 258.416 4 ↓
Lo Low (pH 4.5-6) 2.54 4.22 -56.53 4 4 1 65 259.424 4 ↓

Parameters Provided:

ring.id = 141086
filter.purchasability = annotated
page.format = targets
page.num = 1

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 = 141086 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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