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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

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Popular Name: N-(3-iodo-4-methyl-phenyl)-1H-benzotriazole-5-carboxamide N-(3-iodo-4-methyl-phenyl)-1H-be…

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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) 3.61 5.34 -20.92 2 5 0 71 378.173 2 ↓
Hi High (pH 8-9.5) 3.61 5.14 -45.2 1 5 -1 69 377.165 2 ↓

Analogs

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Popular Name: 2-(1H-benzotriazole-5-carbonylamino)benzoic 2-(1H-benzotriazole-5-carbonylam…

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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) 2.20 4.58 -46.01 2 7 -1 111 281.251 3 ↓
Hi High (pH 8-9.5) 2.20 4.44 -90.82 1 7 -2 109 280.243 3 ↓

Analogs

12535217
12535217
12548245
12548245
12544350
12544350
12535553
12535553
12535176
12535176

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Popular Name: 3-(1H-benzotriazole-5-carbonylamino)benzoic 3-(1H-benzotriazole-5-carbonylam…

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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) 2.04 4.24 -70.5 2 7 -1 111 281.251 3 ↓
Hi High (pH 8-9.5) 2.04 4.18 -109 1 7 -2 109 280.243 3 ↓

Analogs

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Popular Name: 1-ethyl-N-[2-(prop-2-ynylcarbamoyl)phenyl]benzotriazole-5-carboxamide 1-ethyl-N-[2-(prop-2-ynylcarbamo…

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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) 1.90 5.89 -15.12 2 7 0 89 347.378 5 ↓

Analogs

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Popular Name: 1-ethyl-N-(4-methylsulfanylphenyl)benzotriazole-5-carboxamide 1-ethyl-N-(4-methylsulfanylpheny…

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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) 3.03 6.87 -17.59 1 5 0 60 312.398 4 ↓

Analogs

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Popular Name: N-[4-[methoxy(methyl)carbamoyl]phenyl]-1-methyl-benzotriazole-5-carboxamide N-[4-[methoxy(methyl)carbamoyl]p…

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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) 1.62 5.1 -21.97 1 8 0 89 339.355 4 ↓

Analogs

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Popular Name: N-(4-isopropoxy-2-methyl-phenyl)-1-methyl-benzotriazole-5-carboxamide N-(4-isopropoxy-2-methyl-phenyl)…

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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) 3.40 6.7 -17.12 1 6 0 69 324.384 4 ↓

Analogs

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Popular Name: N-[4-(hydroxymethyl)phenyl]-1H-benzotriazole-5-carboxamide N-[4-(hydroxymethyl)phenyl]-1H-b…

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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) 1.49 1 -16.7 3 6 0 91 268.276 3 ↓
Hi High (pH 8-9.5) 1.49 1.11 -45.05 2 6 -1 89 267.268 3 ↓

Analogs

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Popular Name: N-[2-(hydroxymethyl)phenyl]-1H-benzotriazole-5-carboxamide N-[2-(hydroxymethyl)phenyl]-1H-b…

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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) 1.45 1.3 -16.43 3 6 0 91 268.276 3 ↓
Hi High (pH 8-9.5) 1.45 1.16 -43.53 2 6 -1 89 267.268 3 ↓

Parameters Provided:

ring.id = 60193
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 = 60193 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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