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

26147918
26147918

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Popular Name: 3-[(4S)-3-(3,4-dichlorophenyl)-4,5-dihydrotriazol-4-yl]pyridine 3-[(4S)-3-(3,4-dichlorophenyl)-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) 3.38 5.35 -7.26 0 4 0 41 293.157 2 ↓
Lo Low (pH 4.5-6) 3.38 5.78 -37.52 1 4 1 42 294.165 2 ↓

Analogs

26147911
26147911

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Popular Name: 3-[(4R)-3-(3,4-dichlorophenyl)-4,5-dihydrotriazol-4-yl]pyridine 3-[(4R)-3-(3,4-dichlorophenyl)-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) 3.38 5.37 -7.38 0 4 0 41 293.157 2 ↓
Lo Low (pH 4.5-6) 3.38 5.81 -37.44 1 4 1 42 294.165 2 ↓

Analogs

26147933
26147933

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Popular Name: 3-[(4S)-3-(4-bromophenyl)-4,5-dihydrotriazol-4-yl]pyridine 3-[(4S)-3-(4-bromophenyl)-4,5-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) 2.90 5.05 -7.63 0 4 0 41 303.163 2 ↓
Lo Low (pH 4.5-6) 2.90 5.5 -37.97 1 4 1 42 304.171 2 ↓

Analogs

26147926
26147926

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[(4R)-3-(4-bromophenyl)-4,5-dihydrotriazol-4-yl]pyridine 3-[(4R)-3-(4-bromophenyl)-4,5-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) 2.90 4.99 -7.64 0 4 0 41 303.163 2 ↓
Lo Low (pH 4.5-6) 2.90 5.42 -38.16 1 4 1 42 304.171 2 ↓

Parameters Provided:

ring.id = 149291
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 = 149291 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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