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

Analogs

14241528
14241528
14241529
14241529
14241530
14241530
14109353
14109353
14109356
14109356

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Popular Name: (2R)-N-[(4R)-6-fluorothiochroman-4-yl]-2-phenoxy-propanamide (2R)-N-[(4R)-6-fluorothiochroman…

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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) 2.80 9.14 -14.04 1 3 0 38 331.412 4 ↓

Analogs

14241529
14241529
14241530
14241530
14241527
14241527
14109353
14109353

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-[(4R)-6-fluorothiochroman-4-yl]-2-phenoxy-propanamide (2S)-N-[(4R)-6-fluorothiochroman…

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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) 2.80 9.18 -14.2 1 3 0 38 331.412 4 ↓

Analogs

14241530
14241530
14241527
14241527
14241528
14241528

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-N-[(4S)-6-fluorothiochroman-4-yl]-2-phenoxy-propanamide (2R)-N-[(4S)-6-fluorothiochroman…

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) 2.80 9.19 -14.06 1 3 0 38 331.412 4 ↓

Analogs

14241527
14241527
14241528
14241528

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-N-[(4S)-6-fluorothiochroman-4-yl]-2-phenoxy-propanamide (2S)-N-[(4S)-6-fluorothiochroman…

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) 2.80 9.25 -13.95 1 3 0 38 331.412 4 ↓

Analogs

14254975
14254975

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Popular Name: N-[(4R)-6-fluorothiochroman-4-yl]-2-(4-propanoylphenoxy)acetamide N-[(4R)-6-fluorothiochroman-4-yl…

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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) 2.84 9.83 -19.72 1 4 0 55 373.449 6 ↓

Analogs

14254972
14254972

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(4S)-6-fluorothiochroman-4-yl]-2-(4-propanoylphenoxy)acetamide N-[(4S)-6-fluorothiochroman-4-yl…

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) 2.84 9.83 -19.71 1 4 0 55 373.449 6 ↓

Parameters Provided:

ring.id = 236689
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 = 236689 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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