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

3442101
3442101

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Popular Name: 7-[[(4-chlorophenyl)methyl-methyl-amino]methyl]-3-phenyl-thiazolo[3,2-a]pyrimidin-5-one 7-[[(4-chlorophenyl)methyl-methy…

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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) 4.58 11.14 -37.61 1 4 1 39 396.923 5 ↓
Hi High (pH 8-9.5) 4.58 10.72 -11.6 0 4 0 38 395.915 5 ↓

Analogs

3442101
3442101

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Popular Name: 7-[[methyl(p-tolylmethyl)amino]methyl]-3-phenyl-thiazolo[3,2-a]pyrimidin-5-one 7-[[methyl(p-tolylmethyl)amino]m…

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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) 4.35 11.3 -35.28 1 4 1 39 376.505 5 ↓
Hi High (pH 8-9.5) 4.35 10.88 -11.39 0 4 0 38 375.497 5 ↓

Analogs

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Popular Name: 7-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]-3-phenyl-thiazolo[3,2-a]pyrimidin-5-one 7-[[methyl-[(4-methylsulfanylphe…

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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) 4.34 11.65 -37.97 1 4 1 39 408.572 6 ↓
Hi High (pH 8-9.5) 4.34 11.23 -12.48 0 4 0 38 407.564 6 ↓

Analogs

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Popular Name: 7-[[(3-fluorophenyl)methyl-methyl-amino]methyl]-3-phenyl-thiazolo[3,2-a]pyrimidin-5-one 7-[[(3-fluorophenyl)methyl-methy…

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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) 4.04 10.74 -38.19 1 4 1 39 380.468 5 ↓
Hi High (pH 8-9.5) 4.04 10.85 -11.97 0 4 0 38 379.46 5 ↓

Parameters Provided:

ring.id = 587004
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 = 587004 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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