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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

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Popular Name: (3S)-1-[(5R)-5-tert-butyl-4,5,6,7-tetrahydroindoxazene-3-carbonyl]nipecot-ethyl-ester (3S)-1-[(5R)-5-tert-butyl-4,5,6,…

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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) 3.84 3.38 -8.64 0 6 0 72 362.47 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-1-[(5R)-5-tert-butyl-4,5,6,7-tetrahydroindoxazene-3-carbonyl]nipecot-ethyl-ester (3R)-1-[(5R)-5-tert-butyl-4,5,6,…

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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) 3.84 3.37 -8.6 0 6 0 72 362.47 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-1-[(5S)-5-tert-butyl-4,5,6,7-tetrahydroindoxazene-3-carbonyl]nipecot-ethyl-ester (3S)-1-[(5S)-5-tert-butyl-4,5,6,…

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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) 3.84 3.28 -8.62 0 6 0 72 362.47 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-1-[(5S)-5-tert-butyl-4,5,6,7-tetrahydroindoxazene-3-carbonyl]nipecot-ethyl-ester (3R)-1-[(5S)-5-tert-butyl-4,5,6,…

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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) 3.84 3.38 -8.62 0 6 0 72 362.47 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(5R)-5-tert-butyl-4,5,6,7-tetrahydroindoxazene-3-carbonyl]isonipecot-ethyl-ester 1-[(5R)-5-tert-butyl-4,5,6,7-tet…

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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) 3.84 3.43 -10.59 0 6 0 72 362.47 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(5S)-5-tert-butyl-4,5,6,7-tetrahydroindoxazene-3-carbonyl]isonipecot-ethyl-ester 1-[(5S)-5-tert-butyl-4,5,6,7-tet…

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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) 3.84 3.44 -10.56 0 6 0 72 362.47 5 ↓

Analogs

6263632
6263632
9597935
9597935
20851200
20851200

Draw Identity 99% 90% 80% 70%

Popular Name: [(5R)-5-tert-butyl-4,5,6,7-tetrahydroindoxazen-3-yl]-(4-methylpiperidino)methanone [(5R)-5-tert-butyl-4,5,6,7-tetra…

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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) 3.98 2.53 -7.05 0 4 0 46 304.434 2 ↓

Analogs

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Popular Name: 2-[(2R)-1-(4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbonyl)-2-piperidyl]acetamide 2-[(2R)-1-(4,5,6,7-tetrahydro-1,…

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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) 2.40 4.76 -11.75 2 6 0 89 291.351 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2S)-1-(4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbonyl)-2-piperidyl]acetamide 2-[(2S)-1-(4,5,6,7-tetrahydro-1,…

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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) 2.40 4.72 -11.74 2 6 0 89 291.351 3 ↓

Parameters Provided:

ring.id = 242800
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 = 242800 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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