UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 2-acetamido-N-cyclopropyl-N-(2-hydroxyethyl)thiazole-4-carboxamide 2-acetamido-N-cyclopropyl-N-(2-h…

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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) -0.38 1.99 -13.25 2 6 0 83 269.326 5 ↓

Analogs

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Popular Name: N-cyclopropyl-2-methyl-thiazole-4-carboxamide N-cyclopropyl-2-methyl-thiazole-…

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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) 0.38 2.12 -8.36 1 3 0 42 182.248 2 ↓

Analogs

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Popular Name: N-cyclopropylthiazole-4-carboxamide N-cyclopropylthiazole-4-carboxamide

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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) 0.67 1.39 -8.72 1 3 0 42 168.221 2 ↓

Analogs

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Popular Name: N-cyclopropyl-N-ethyl-thiazole-4-carboxamide N-cyclopropyl-N-ethyl-thiazole-4…

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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 5.21 -8.52 0 3 0 33 196.275 3 ↓

Analogs

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Popular Name: N-cyclopropyl-N-methyl-thiazole-4-carboxamide N-cyclopropyl-N-methyl-thiazole-…

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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) 0.91 3.75 -9.27 0 3 0 33 182.248 2 ↓

Analogs

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Popular Name: N-cyclopropyl-N-propyl-thiazole-4-carboxamide N-cyclopropyl-N-propyl-thiazole-…

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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) 1.79 5.95 -8.17 0 3 0 33 210.302 4 ↓

Analogs

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Popular Name: N-(1-cyano-1-methyl-ethyl)-N-cyclopropyl-thiazole-4-carboxamide N-(1-cyano-1-methyl-ethyl)-N-cyc…

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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) 1.50 5.8 -8.99 0 4 0 57 235.312 3 ↓

Analogs

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Popular Name: N-cyclopropyl-N-isobutyl-thiazole-4-carboxamide N-cyclopropyl-N-isobutyl-thiazol…

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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 6.63 -8.3 0 3 0 33 224.329 4 ↓

Analogs

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Popular Name: N-cyclopropyl-N-isopentyl-thiazole-4-carboxamide N-cyclopropyl-N-isopentyl-thiazo…

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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) 2.56 7.27 -7.6 0 3 0 33 238.356 5 ↓

Analogs

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Popular Name: N-butyl-N-cyclopropyl-thiazole-4-carboxamide N-butyl-N-cyclopropyl-thiazole-4…

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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) 2.35 6.74 -8.15 0 3 0 33 224.329 5 ↓

Analogs

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Popular Name: N-cyclopropyl-N-(2-methoxyethyl)thiazole-4-carboxamide N-cyclopropyl-N-(2-methoxyethyl)…

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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) 0.90 4.85 -9.34 0 4 0 42 226.301 5 ↓

Analogs

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Popular Name: N-cyclopropyl-N-(2,2,2-trifluoroethyl)thiazole-4-carboxamide N-cyclopropyl-N-(2,2,2-trifluoro…

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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 5.63 -9.51 0 3 0 33 250.245 4 ↓

Analogs

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Popular Name: N-[(1S)-2,2-dimethylcyclopropyl]thiazole-4-carboxamide N-[(1S)-2,2-dimethylcyclopropyl]…

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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) 1.23 2.74 -8.64 1 3 0 42 196.275 2 ↓

Analogs

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Popular Name: N-[(1R)-2,2-dimethylcyclopropyl]thiazole-4-carboxamide N-[(1R)-2,2-dimethylcyclopropyl]…

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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) 1.23 2.74 -8.64 1 3 0 42 196.275 2 ↓

Analogs

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Popular Name: N-[(1S,2R)-2-methylcyclopropyl]thiazole-4-carboxamide N-[(1S,2R)-2-methylcyclopropyl]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) 1.27 2.23 -8.63 1 3 0 42 182.248 2 ↓

Analogs

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Popular Name: N-[(1S,2S)-2-methylcyclopropyl]thiazole-4-carboxamide N-[(1S,2S)-2-methylcyclopropyl]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) 1.27 2.06 -8.65 1 3 0 42 182.248 2 ↓

Analogs

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Popular Name: N-[(1R,2R)-2-methylcyclopropyl]thiazole-4-carboxamide N-[(1R,2R)-2-methylcyclopropyl]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) 1.27 2.06 -8.66 1 3 0 42 182.248 2 ↓

Analogs

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Popular Name: N-[(1R,2S)-2-methylcyclopropyl]thiazole-4-carboxamide N-[(1R,2S)-2-methylcyclopropyl]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) 1.27 2.23 -8.65 1 3 0 42 182.248 2 ↓

Analogs

33718042
33718042

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Popular Name: N-cyclopropyl-2-isobutyl-thiazole-4-carboxamide N-cyclopropyl-2-isobutyl-thiazol…

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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) 1.70 4.13 -7.62 1 3 0 42 224.329 4 ↓

Analogs

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Popular Name: 2-acetamido-N-cyclopropyl-N-[(1R)-1,2-dimethylpropyl]thiazole-4-carboxamide 2-acetamido-N-cyclopropyl-N-[(1R…

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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) 1.71 7 -11.23 1 5 0 62 295.408 5 ↓

Analogs

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Popular Name: 2-acetamido-N-cyclopropyl-N-[(1S)-1,2-dimethylpropyl]thiazole-4-carboxamide 2-acetamido-N-cyclopropyl-N-[(1S…

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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) 1.71 6.9 -11.26 1 5 0 62 295.408 5 ↓

Parameters Provided:

ring.id = 63203
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 = 63203 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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