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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: N-cyclopropyl-2-[[(3R)-1,1-dioxothian-3-yl]amino]-N-methyl-acetamide N-cyclopropyl-2-[[(3R)-1,1-dioxo…

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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) -0.40 1.76 -57.94 2 5 1 71 261.367 4 ↓
Mid Mid (pH 6-8) -0.40 0.59 -16.37 1 5 0 66 260.359 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-cyclopropyl-2-[[(3S)-1,1-dioxothian-3-yl]amino]-N-methyl-acetamide N-cyclopropyl-2-[[(3S)-1,1-dioxo…

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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) -0.40 1.76 -57.7 2 5 1 71 261.367 4 ↓
Mid Mid (pH 6-8) -0.40 0.6 -17.15 1 5 0 66 260.359 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-cyclopropyl-2-[[(3R)-1,1-dioxothian-3-yl]amino]-N-ethyl-acetamide N-cyclopropyl-2-[[(3R)-1,1-dioxo…

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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) -0.02 2.49 -57.43 2 5 1 71 275.394 5 ↓
Mid Mid (pH 6-8) -0.02 1.32 -15.97 1 5 0 66 274.386 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-cyclopropyl-2-[[(3S)-1,1-dioxothian-3-yl]amino]-N-ethyl-acetamide N-cyclopropyl-2-[[(3S)-1,1-dioxo…

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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) -0.02 2.48 -57.25 2 5 1 71 275.394 5 ↓
Mid Mid (pH 6-8) -0.02 1.35 -16.7 1 5 0 66 274.386 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-cyclopropyl-2-[[(3R)-1,1-dioxothian-3-yl]amino]propanamide (2S)-N-cyclopropyl-2-[[(3R)-1,1-…

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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) -0.31 0.68 -51.66 3 5 1 80 261.367 4 ↓
Mid Mid (pH 6-8) -0.31 -0.39 -16.73 2 5 0 75 260.359 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-cyclopropyl-2-[[(3R)-1,1-dioxothian-3-yl]amino]propanamide (2R)-N-cyclopropyl-2-[[(3R)-1,1-…

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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) -0.31 0.62 -53.36 3 5 1 80 261.367 4 ↓
Mid Mid (pH 6-8) -0.31 -0.36 -15.41 2 5 0 75 260.359 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-cyclopropyl-2-[[(3S)-1,1-dioxothian-3-yl]amino]propanamide (2S)-N-cyclopropyl-2-[[(3S)-1,1-…

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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) -0.31 0.62 -53.38 3 5 1 80 261.367 4 ↓
Mid Mid (pH 6-8) -0.31 -0.44 -15 2 5 0 75 260.359 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-cyclopropyl-2-[[(3S)-1,1-dioxothian-3-yl]amino]propanamide (2R)-N-cyclopropyl-2-[[(3S)-1,1-…

Find On: PubMed — Wikipedia — Google

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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) -0.31 0.65 -51.68 3 5 1 80 261.367 4 ↓
Mid Mid (pH 6-8) -0.31 -0.37 -20.35 2 5 0 75 260.359 4 ↓

Parameters Provided:

ring.id = 290034
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 = 290034 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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