UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: N-[1-[5-(4-carbamoylphenyl)-1H-imidazol-2-yl]-1-methyl-ethyl]-13-cyclohexyl-3-methoxy-6,7-dihydroind N-[1-[5-(4-carbamoylphenyl)-1H-i…

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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) 5.78 12.22 -19.37 4 9 0 124 617.75 7 ↓
Lo Low (pH 4.5-6) 5.78 12.69 -55.83 5 9 1 126 618.758 7 ↓

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Popular Name: 4-[2-[1-[(13-cyclohexyl-3-methoxy-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carbonyl)amino]-1-me 4-[2-[1-[(13-cyclohexyl-3-methox…

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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) 6.87 15.97 -56.23 2 9 -1 121 617.726 7 ↓
Lo Low (pH 4.5-6) 6.87 16.44 -78.58 3 9 0 123 618.734 7 ↓

Analogs

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Popular Name: 13-cyclohexyl-N-[1-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]-1-methyl-ethyl]-6,7-dihydroindolo[1,2-d][1 13-cyclohexyl-N-[1-[5-(4-methoxy…

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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) 6.98 15.44 -13.39 2 7 0 81 574.725 6 ↓
Lo Low (pH 4.5-6) 6.98 15.91 -44.91 3 7 1 82 575.733 6 ↓

Parameters Provided:

ring.id = 196406
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 = 196406 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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