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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

26145504
26145504
26148410
26148410
26148421
26148421
26151587
26151587
26157545
26157545

Draw Identity 99% 90% 80% 70%

Popular Name: 6-methoxy-N-[(3R)-1-propylazepan-3-yl]-3H-benzotriazole-5-carboxamide 6-methoxy-N-[(3R)-1-propylazepan…

Find On: PubMed — Wikipedia — Google

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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) 2.79 5.88 -52.11 3 7 1 84 332.428 5 ↓
Mid Mid (pH 6-8) 2.79 5.83 -61.06 2 7 0 83 331.42 5 ↓

Analogs

26148410
26148410
26148421
26148421
26151587
26151587
26157545
26157545
26157551
26157551

Draw Identity 99% 90% 80% 70%

Popular Name: 6-methoxy-N-[(3S)-1-propylazepan-3-yl]-3H-benzotriazole-5-carboxamide 6-methoxy-N-[(3S)-1-propylazepan…

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) 2.79 5.9 -52.77 3 7 1 84 332.428 5 ↓
Mid Mid (pH 6-8) 2.79 5.91 -61.35 2 7 0 83 331.42 5 ↓

Parameters Provided:

ring.id = 148910
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 = 148910 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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