UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: N-[4-(4-aminophenyl)thiazol-2-yl]-5-chloro-thiophene-2-carboxamide N-[4-(4-aminophenyl)thiazol-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) 3.33 6.08 -8.25 3 4 0 68 335.841 3 ↓

Analogs

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Popular Name: N-[4-(4-iodophenyl)thiazol-2-yl]-5-nitro-thiophene-2-carboxamide N-[4-(4-iodophenyl)thiazol-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) 4.62 -1.68 -9.31 1 6 0 88 457.274 4 ↓

Analogs

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Popular Name: N-[4-[4-(1-acetylaminoethyl)phenyl]thiazol-2-yl]-5-bromo-thiophene-2-carboxamide N-[4-[4-(1-acetylaminoethyl)phen…

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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) 3.87 -3.35 -13.4 2 5 0 71 450.383 5 ↓

Analogs

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Popular Name: N-[4-[4-(1-acetylaminoethyl)phenyl]thiazol-2-yl]-5-bromo-thiophene-2-carboxamide N-[4-[4-(1-acetylaminoethyl)phen…

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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) 3.87 -3.35 -13.3 2 5 0 71 450.383 5 ↓

Analogs

7794534
7794534

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Popular Name: N-[4-(4-tert-butylphenyl)thiazol-2-yl]-5-nitro-thiophene-2-carboxamide N-[4-(4-tert-butylphenyl)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) 5.24 10.8 -9.36 1 6 0 88 387.486 5 ↓
Hi High (pH 8-9.5) 5.31 8.44 -34.96 0 6 -1 94 386.478 5 ↓

Analogs

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Popular Name: N-[4-(4-butoxyphenyl)thiazol-2-yl]thiophene-2-carboxamide N-[4-(4-butoxyphenyl)thiazol-2-y…

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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) 4.95 -0.99 -9.67 1 4 0 51 358.488 7 ↓

Analogs

929210
929210

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Popular Name: N-(2-methoxyethyl)-N-[4-(4-methoxyphenyl)thiazol-2-yl]-thiophene-2-carboxamide N-(2-methoxyethyl)-N-[4-(4-metho…

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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) 3.74 -0.25 -11.59 0 5 0 51 374.487 7 ↓

Analogs

929210
929210

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Popular Name: N-[4-(4-methoxyphenyl)thiazol-2-yl]-N-(3-methoxypropyl)thiophene-2-carboxamide N-[4-(4-methoxyphenyl)thiazol-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) 4.01 -0.22 -11.85 0 5 0 51 388.514 8 ↓

Analogs

4375209
4375209
929210
929210

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Popular Name: N-(3-dimethylaminopropyl)-N-[4-(4-methoxyphenyl)thiazol-2-yl]-thiophene-2-carboxamide N-(3-dimethylaminopropyl)-N-[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) 4.06 11.11 -59.77 1 5 1 47 402.565 8 ↓

Analogs

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Popular Name: N-[4-(3-bromophenyl)thiazol-2-yl]-3-methyl-thiophene-2-carboxamide N-[4-(3-bromophenyl)thiazol-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) 4.62 8.87 -9.23 1 3 0 42 379.304 3 ↓

Analogs

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Popular Name: 5-(acetamidomethyl)-N-[4-(2,6-difluorophenyl)thiazol-2-yl]thiophene-2-carboxamide 5-(acetamidomethyl)-N-[4-(2,6-di…

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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) 2.85 7.01 -15.11 2 5 0 71 393.44 5 ↓

Analogs

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Popular Name: 5-(acetamidomethyl)-N-[4-(2-methoxyphenyl)thiazol-2-yl]thiophene-2-carboxamide 5-(acetamidomethyl)-N-[4-(2-meth…

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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) 2.62 6.54 -15.65 2 6 0 80 387.486 6 ↓

Analogs

14376341
14376341
36736786
36736786

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Popular Name: 5-methyl-N-(4-phenylthiazol-2-yl)thiophene-2-carboxamide 5-methyl-N-(4-phenylthiazol-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) 3.68 8.39 -8.92 1 3 0 42 300.408 3 ↓

Parameters Provided:

ring.id = 18047
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 = 18047 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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