UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

11832490
11832490
11955627
11955627

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Popular Name: (Z)-3-[3-[(4-fluorophenyl)methoxy]-4-methoxy-phenyl]-2-phenyl-prop-2-enoic (Z)-3-[3-[(4-fluorophenyl)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) 4.65 2.81 -53.77 0 4 -1 59 377.391 7 ↓

Analogs

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Popular Name: (Z)-3-[3-[(2-fluorophenyl)methoxy]phenyl]-2-(4-methoxyphenyl)prop-2-enoic (Z)-3-[3-[(2-fluorophenyl)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) 5.05 2.61 -53.08 0 4 -1 59 377.391 7 ↓

Analogs

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Popular Name: (Z)-3-[3-[(4-fluorophenyl)methoxy]phenyl]-2-(4-methoxyphenyl)prop-2-enoic (Z)-3-[3-[(4-fluorophenyl)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) 5.09 2.51 -52.43 0 4 -1 59 377.391 7 ↓

Analogs

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Popular Name: (Z)-3-[3-[(2-fluorophenyl)methoxy]phenyl]-2-phenyl-prop-2-enoic (Z)-3-[3-[(2-fluorophenyl)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) 4.99 2.58 -53.37 0 3 -1 49 347.365 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (Z)-3-[3-[(4-fluorophenyl)methoxy]phenyl]-2-phenyl-prop-2-enoic (Z)-3-[3-[(4-fluorophenyl)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) 5.04 2.47 -52.55 0 3 -1 49 347.365 6 ↓

Analogs

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Popular Name: (Z)-3-[3-(o-tolylmethoxy)phenyl]-2-phenyl-prop-2-enoic (Z)-3-[3-(o-tolylmethoxy)phenyl]…

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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) 5.27 2.1 -53.38 0 3 -1 49 343.402 6 ↓

Analogs

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Popular Name: (E)-3-[3-(o-tolylmethoxy)phenyl]-2-phenyl-prop-2-enoic (E)-3-[3-(o-tolylmethoxy)phenyl]…

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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) 5.27 2.26 -56.43 0 3 -1 49 343.402 6 ↓

Analogs

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Popular Name: (Z)-3-[3-(m-tolylmethoxy)phenyl]-2-phenyl-prop-2-enoic (Z)-3-[3-(m-tolylmethoxy)phenyl]…

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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) 5.30 2.05 -53.29 0 3 -1 49 343.402 6 ↓

Analogs

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Popular Name: (Z)-3-[3-[(2-chloro-6-fluoro-phenyl)methoxy]phenyl]-2-phenyl-prop-2-enoic (Z)-3-[3-[(2-chloro-6-fluoro-phe…

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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) 5.62 2.28 -55.48 0 3 -1 49 381.81 6 ↓

Analogs

11948708
11948708

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Popular Name: (Z)-3-[3-[(2-chlorophenyl)methoxy]phenyl]-2-phenyl-prop-2-enoic (Z)-3-[3-[(2-chlorophenyl)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) 5.50 1.67 -52.9 0 3 -1 49 363.82 6 ↓

Analogs

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Popular Name: (Z)-3-[3-[(3-chlorophenyl)methoxy]phenyl]-2-(4-methoxyphenyl)prop-2-enoic (Z)-3-[3-[(3-chlorophenyl)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) 5.58 1.63 -53.34 0 4 -1 59 393.846 7 ↓

Analogs

11959223
11959223
11863924
11863924
11948981
11948981

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Popular Name: (Z)-3-(3-benzyloxy-4-methoxy-phenyl)-2-phenyl-prop-2-enoic (Z)-3-(3-benzyloxy-4-methoxy-phe…

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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) 4.49 2.07 -54.95 0 4 -1 59 359.401 7 ↓

Parameters Provided:

ring.id = 42066
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 = 42066 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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