Warning: session_write_close() [function.session-write-close]: open(/tmp/session/sess_l9n6hl62t41q47sgn7edoiojl7, O_RDWR) failed: No such file or directory (2) in /domains/zinc12/htdocs/lib/zinc/user/ZincAuthentication.php on line 109

Warning: session_write_close() [function.session-write-close]: Failed to write session data (files). Please verify that the current setting of session.save_path is correct (/tmp/session) in /domains/zinc12/htdocs/lib/zinc/user/ZincAuthentication.php on line 109
Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

12232805
12232805
14007830
14007830
14007834
14007834

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-methyl-7-phenyl-thiazolo[4,5-d]pyridazin-4-yl)sulfanyl-N-[[(2S)-tetrahydrofuran-2-yl]methyl]ace 2-(2-methyl-7-phenyl-thiazolo[4,…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 2.55 -4.36 -15.54 1 6 0 77 400.529 6 ↓

Analogs

14007830
14007830
14007834
14007834
12232801
12232801

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-methyl-7-phenyl-thiazolo[4,5-d]pyridazin-4-yl)sulfanyl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]ace 2-(2-methyl-7-phenyl-thiazolo[4,…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 2.55 -4.3 -15.39 1 6 0 77 400.529 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[7-(4-methoxyphenyl)-2-methyl-thiazolo[4,5-d]pyridazin-4-yl]sulfanyl-N-[[(2S)-tetrahydrofuran-2-yl 2-[7-(4-methoxyphenyl)-2-methyl-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 2.61 5.25 -15.65 1 7 0 86 430.555 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[7-(4-methoxyphenyl)-2-methyl-thiazolo[4,5-d]pyridazin-4-yl]sulfanyl-N-[[(2R)-tetrahydrofuran-2-yl 2-[7-(4-methoxyphenyl)-2-methyl-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 2.61 5.29 -15.66 1 7 0 86 430.555 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[7-(3-methoxyphenyl)-2-methyl-thiazolo[4,5-d]pyridazin-4-yl]sulfanyl-N-[[(2S)-tetrahydrofuran-2-yl 2-[7-(3-methoxyphenyl)-2-methyl-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 2.58 5.25 -17.55 1 7 0 86 430.555 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[7-(3-methoxyphenyl)-2-methyl-thiazolo[4,5-d]pyridazin-4-yl]sulfanyl-N-[[(2R)-tetrahydrofuran-2-yl 2-[7-(3-methoxyphenyl)-2-methyl-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 2.58 5.29 -17.4 1 7 0 86 430.555 7 ↓

Analogs

12232801
12232801
12232805
12232805

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[2-methyl-7-(p-tolyl)thiazolo[4,5-d]pyridazin-4-yl]sulfanyl-N-[[(2S)-tetrahydrofuran-2-yl]methyl]a 2-[2-methyl-7-(p-tolyl)thiazolo[…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 3.00 6.63 -15.44 1 6 0 77 414.556 6 ↓

Analogs

12232801
12232801
12232805
12232805

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[2-methyl-7-(p-tolyl)thiazolo[4,5-d]pyridazin-4-yl]sulfanyl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]a 2-[2-methyl-7-(p-tolyl)thiazolo[…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 3.00 6.67 -15.37 1 6 0 77 414.556 6 ↓

Parameters Provided:

ring.id = 97506
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 = 97506 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

Permalink

//zinc12.docking.org/results/combination?ring.id=97506&filter.purchasability=annotated

Embed Link to Results