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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

41545815
41545815

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Popular Name: (2S)-N-[(2-ethylpyrazol-3-yl)methyl]-N,2-dimethyl-3-oxo-4H-1,4-benzoxazine-2-carboxamide (2S)-N-[(2-ethylpyrazol-3-yl)met…

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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 6.91 -18.31 1 7 0 76 328.372 4 ↓

Analogs

41545812
41545812

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Popular Name: (2R)-N-[(2-ethylpyrazol-3-yl)methyl]-N,2-dimethyl-3-oxo-4H-1,4-benzoxazine-2-carboxamide (2R)-N-[(2-ethylpyrazol-3-yl)met…

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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 5.06 -16.41 1 7 0 76 328.372 4 ↓

Analogs

41545821
41545821

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Popular Name: (2R)-N-[(2-ethylpyrazol-3-yl)methyl]-2-methyl-3-oxo-4H-1,4-benzoxazine-2-carboxamide (2R)-N-[(2-ethylpyrazol-3-yl)met…

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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) 0.99 4.48 -13.37 2 7 0 85 314.345 4 ↓

Analogs

41545818
41545818

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Popular Name: (2S)-N-[(2-ethylpyrazol-3-yl)methyl]-2-methyl-3-oxo-4H-1,4-benzoxazine-2-carboxamide (2S)-N-[(2-ethylpyrazol-3-yl)met…

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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) 0.99 2.95 -12.85 2 7 0 85 314.345 4 ↓

Analogs

41545827
41545827

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Popular Name: (2R)-N,2-dimethyl-N-[(2-methylpyrazol-3-yl)methyl]-3-oxo-4H-1,4-benzoxazine-2-carboxamide (2R)-N,2-dimethyl-N-[(2-methylpy…

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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) 0.86 3.98 -14.69 1 7 0 76 314.345 3 ↓

Analogs

41545824
41545824

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Popular Name: (2S)-N,2-dimethyl-N-[(2-methylpyrazol-3-yl)methyl]-3-oxo-4H-1,4-benzoxazine-2-carboxamide (2S)-N,2-dimethyl-N-[(2-methylpy…

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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) 0.86 5.47 -15.99 1 7 0 76 314.345 3 ↓

Analogs

41547437
41547437

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Popular Name: (2S)-N-[(2-ethylpyrazol-3-yl)methyl]-N,2,6-trimethyl-3-oxo-4H-1,4-benzoxazine-2-carboxamide (2S)-N-[(2-ethylpyrazol-3-yl)met…

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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) 1.66 7.58 -17.97 1 7 0 76 342.399 4 ↓

Analogs

41547434
41547434

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Popular Name: (2R)-N-[(2-ethylpyrazol-3-yl)methyl]-N,2,6-trimethyl-3-oxo-4H-1,4-benzoxazine-2-carboxamide (2R)-N-[(2-ethylpyrazol-3-yl)met…

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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) 1.66 5.73 -16.11 1 7 0 76 342.399 4 ↓

Analogs

41547443
41547443

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Popular Name: (2R)-N-[(2-ethylpyrazol-3-yl)methyl]-2,6-dimethyl-3-oxo-4H-1,4-benzoxazine-2-carboxamide (2R)-N-[(2-ethylpyrazol-3-yl)met…

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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) 1.41 5.13 -13.02 2 7 0 85 328.372 4 ↓

Analogs

41547440
41547440

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Popular Name: (2S)-N-[(2-ethylpyrazol-3-yl)methyl]-2,6-dimethyl-3-oxo-4H-1,4-benzoxazine-2-carboxamide (2S)-N-[(2-ethylpyrazol-3-yl)met…

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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) 1.41 3.61 -12.53 2 7 0 85 328.372 4 ↓

Analogs

41547449
41547449

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Popular Name: (2S)-N,2,6-trimethyl-N-[(2-methylpyrazol-3-yl)methyl]-3-oxo-4H-1,4-benzoxazine-2-carboxamide (2S)-N,2,6-trimethyl-N-[(2-methy…

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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) 1.28 6.12 -15.71 1 7 0 76 328.372 3 ↓

Analogs

41547446
41547446

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Popular Name: (2R)-N,2,6-trimethyl-N-[(2-methylpyrazol-3-yl)methyl]-3-oxo-4H-1,4-benzoxazine-2-carboxamide (2R)-N,2,6-trimethyl-N-[(2-methy…

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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) 1.28 4.65 -14.35 1 7 0 76 328.372 3 ↓

Analogs

41549018
41549018

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Popular Name: (2S)-6-chloro-N-[(2-ethylpyrazol-3-yl)methyl]-N,2-dimethyl-3-oxo-4H-1,4-benzoxazine-2-carboxamide (2S)-6-chloro-N-[(2-ethylpyrazol…

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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) 1.89 7.43 -17.74 1 7 0 76 362.817 4 ↓

Analogs

41549016
41549016

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Popular Name: (2R)-6-chloro-N-[(2-ethylpyrazol-3-yl)methyl]-N,2-dimethyl-3-oxo-4H-1,4-benzoxazine-2-carboxamide (2R)-6-chloro-N-[(2-ethylpyrazol…

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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) 1.89 5.57 -15.68 1 7 0 76 362.817 4 ↓

Analogs

41549022
41549022

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Popular Name: (2R)-6-chloro-N-[(2-ethylpyrazol-3-yl)methyl]-2-methyl-3-oxo-4H-1,4-benzoxazine-2-carboxamide (2R)-6-chloro-N-[(2-ethylpyrazol…

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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) 1.64 4.99 -12.55 2 7 0 85 348.79 4 ↓

Analogs

41549020
41549020

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Popular Name: (2S)-6-chloro-N-[(2-ethylpyrazol-3-yl)methyl]-2-methyl-3-oxo-4H-1,4-benzoxazine-2-carboxamide (2S)-6-chloro-N-[(2-ethylpyrazol…

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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) 1.64 3.46 -11.96 2 7 0 85 348.79 4 ↓

Analogs

41549026
41549026

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Popular Name: (2R)-6-chloro-N,2-dimethyl-N-[(2-methylpyrazol-3-yl)methyl]-3-oxo-4H-1,4-benzoxazine-2-carboxamide (2R)-6-chloro-N,2-dimethyl-N-[(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) 1.51 4.51 -14.04 1 7 0 76 348.79 3 ↓

Analogs

41549024
41549024

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Popular Name: (2S)-6-chloro-N,2-dimethyl-N-[(2-methylpyrazol-3-yl)methyl]-3-oxo-4H-1,4-benzoxazine-2-carboxamide (2S)-6-chloro-N,2-dimethyl-N-[(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) 1.51 5.99 -15.21 1 7 0 76 348.79 3 ↓

Parameters Provided:

ring.id = 546915
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 = 546915 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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