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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

Draw Identity 99% 90% 80% 70%

Popular Name: tert-butyl tert-butyl

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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) 1.82 6.56 -18.44 1 6 0 72 329.447 4 ↓

Analogs

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Popular Name: (4S)-3-[(Z)-2-methylpent-2-enoyl]-N-(5-methylthiazol-2-yl)thiazolidine-4-carboxamide (4S)-3-[(Z)-2-methylpent-2-enoyl…

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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) 2.05 7.77 -18.53 1 5 0 62 325.459 4 ↓

Analogs

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Popular Name: (4R)-3-[(Z)-2-methylpent-2-enoyl]-N-(5-methylthiazol-2-yl)thiazolidine-4-carboxamide (4R)-3-[(Z)-2-methylpent-2-enoyl…

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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) 2.05 8.15 -22.55 1 5 0 62 325.459 4 ↓

Analogs

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Popular Name: (NZ,4R)-3-(3-isopropoxypropanoyl)-N-(5-methyl-3H-thiazol-2-ylidene)thiazolidine-4-carboxamide (NZ,4R)-3-(3-isopropoxypropanoyl…

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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) 1.10 6.71 -19.32 1 6 0 72 343.474 6 ↓

Analogs

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Popular Name: (NZ,4S)-3-(3-isopropoxypropanoyl)-N-(5-methyl-3H-thiazol-2-ylidene)thiazolidine-4-carboxamide (NZ,4S)-3-(3-isopropoxypropanoyl…

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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) 1.10 6.85 -21.06 1 6 0 72 343.474 6 ↓

Analogs

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Popular Name: (4S)-N-methyl-3-[(Z)-2-methylpent-2-enoyl]-N-thiazol-2-yl-thiazolidine-4-carboxamide (4S)-N-methyl-3-[(Z)-2-methylpen…

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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) 2.07 7.2 -18.98 0 5 0 54 325.459 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-N-methyl-3-[(Z)-2-methylpent-2-enoyl]-N-thiazol-2-yl-thiazolidine-4-carboxamide (4R)-N-methyl-3-[(Z)-2-methylpen…

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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) 2.07 8.55 -24.82 0 5 0 54 325.459 4 ↓

Analogs

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Popular Name: (4R)-3-(2,2-dimethylpropanoyl)-N-(4,5-dimethylthiazol-2-yl)thiazolidine-4-carboxamide (4R)-3-(2,2-dimethylpropanoyl)-N…

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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) 2.03 7.02 -20.04 1 5 0 62 327.475 3 ↓

Analogs

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Popular Name: (4S)-3-(2,2-dimethylpropanoyl)-N-(4,5-dimethylthiazol-2-yl)thiazolidine-4-carboxamide (4S)-3-(2,2-dimethylpropanoyl)-N…

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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) 2.03 7.3 -22.21 1 5 0 62 327.475 3 ↓

Analogs

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Popular Name: (NZ,4R)-3-(3-methylbut-2-enoyl)-N-(5-methyl-3H-thiazol-2-ylidene)thiazolidine-4-carboxamide (NZ,4R)-3-(3-methylbut-2-enoyl)-…

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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) 1.78 7.1 -19 1 5 0 62 311.432 3 ↓

Analogs

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Popular Name: (NZ,4S)-3-(3-methylbut-2-enoyl)-N-(5-methyl-3H-thiazol-2-ylidene)thiazolidine-4-carboxamide (NZ,4S)-3-(3-methylbut-2-enoyl)-…

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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) 1.78 7.21 -20.75 1 5 0 62 311.432 3 ↓

Analogs

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Popular Name: (4R)-N-(4-isopropylthiazol-2-yl)thiazolidine-4-carboxamide (4R)-N-(4-isopropylthiazol-2-yl)…

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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) 1.60 2.5 -9.98 2 4 0 54 257.384 3 ↓
Mid Mid (pH 6-8) 1.78 2.08 -34.32 2 4 0 65 257.384 3 ↓
Mid Mid (pH 6-8) 2.52 3.12 -33.9 3 4 1 62 258.392 2 ↓

Analogs

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Popular Name: (4S)-N-(4-isopropylthiazol-2-yl)thiazolidine-4-carboxamide (4S)-N-(4-isopropylthiazol-2-yl)…

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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) 1.60 2.33 -7.34 2 4 0 54 257.384 3 ↓
Mid Mid (pH 6-8) 1.78 2.14 -33.95 2 4 0 65 257.384 3 ↓
Mid Mid (pH 6-8) 2.52 3.12 -34.01 3 4 1 62 258.392 2 ↓

Parameters Provided:

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filter.purchasability = annotated
page.format = targets
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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 = 354056 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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