UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

33025402
33025402
33025401
33025401
33025263
33025263
33025264
33025264
33010617
33010617

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Popular Name: 4-[[2-(3-fluorophenyl)pyrimidin-4-yl]amino]-N-[(1S)-tetralin-1-yl]benzamide 4-[[2-(3-fluorophenyl)pyrimidin-…

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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) 5.04 13.63 -13.97 2 5 0 67 438.506 5 ↓

Analogs

33025402
33025402
33025401
33025401
33025263
33025263
33025264
33025264
33010617
33010617

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[2-(3-fluorophenyl)pyrimidin-4-yl]amino]-N-[(1R)-tetralin-1-yl]benzamide 4-[[2-(3-fluorophenyl)pyrimidin-…

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) 5.04 13.62 -14.29 2 5 0 67 438.506 5 ↓

Analogs

33025401
33025401
33025402
33025402
33025263
33025263
33025264
33025264

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[(2-phenylpyrimidin-4-yl)amino]-N-[(1R)-tetralin-1-yl]benzamide 4-[(2-phenylpyrimidin-4-yl)amino…

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) 4.90 13.55 -15.83 2 5 0 67 420.516 5 ↓

Analogs

33025401
33025401
33025402
33025402
33025263
33025263
33025264
33025264

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[(2-phenylpyrimidin-4-yl)amino]-N-[(1S)-tetralin-1-yl]benzamide 4-[(2-phenylpyrimidin-4-yl)amino…

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) 4.90 13.55 -15.91 2 5 0 67 420.516 5 ↓

Parameters Provided:

ring.id = 18409
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 = 18409 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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