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

Draw Identity 99% 90% 80% 70%

Popular Name: (8R,9S,13S,14S,16R,17S)-3,17-dihydroxy-13-methyl-N-[[(2S)-tetrahydrofuran-2-yl]methyl]-6,7,8,9,11,12 (8R,9S,13S,14S,16R,17S)-3,17-dih…

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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) 3.01 4.25 -10.18 3 5 0 79 399.531 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (8R,9S,13S,14S,16S,17S)-3,17-dihydroxy-13-methyl-N-[[(2S)-tetrahydrofuran-2-yl]methyl]-6,7,8,9,11,12 (8R,9S,13S,14S,16S,17S)-3,17-dih…

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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) 3.01 4.34 -12.42 3 5 0 79 399.531 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (8R,9S,13S,14S,16R,17S)-3,17-dihydroxy-13-methyl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]-6,7,8,9,11,12 (8R,9S,13S,14S,16R,17S)-3,17-dih…

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) 3.01 4.29 -10.52 3 5 0 79 399.531 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (8R,9S,13S,14S,16S,17S)-3,17-dihydroxy-13-methyl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]-6,7,8,9,11,12 (8R,9S,13S,14S,16S,17S)-3,17-dih…

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) 3.01 4.3 -12.3 3 5 0 79 399.531 3 ↓

Parameters Provided:

ring.id = 225234
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 = 225234 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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