UCSF
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Analogs

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Popular Name: 1-(3-aminophenyl)-3-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-yl)urea 1-(3-aminophenyl)-3-(5,6-dihydro…

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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) 2.22 4.2 -16.39 4 5 0 80 274.349 2 ↓

Analogs

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Popular Name: 1-(4-aminophenyl)-3-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-yl)urea 1-(4-aminophenyl)-3-(5,6-dihydro…

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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) 2.24 4.2 -16.81 4 5 0 80 274.349 2 ↓

Analogs

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Popular Name: 3-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-ylcarbamoylamino)benzoic 3-(5,6-dihydro-4H-cyclopenta[d]t…

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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) 3.05 6.89 -75 2 6 -1 94 302.335 3 ↓

Analogs

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Popular Name: 2-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-ylcarbamoylamino)benzoic 2-(5,6-dihydro-4H-cyclopenta[d]t…

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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) 3.21 7.23 -52.16 2 6 -1 94 302.335 3 ↓

Analogs

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Popular Name: 4-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-ylcarbamoylamino)benzoic 4-(5,6-dihydro-4H-cyclopenta[d]t…

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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) 3.08 6.87 -62.84 2 6 -1 94 302.335 3 ↓

Analogs

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Popular Name: 1-(3-acetylphenyl)-3-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-yl)urea 1-(3-acetylphenyl)-3-(5,6-dihydr…

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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) 3.04 6.81 -26.32 2 5 0 71 301.371 3 ↓

Analogs

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Popular Name: 1-(4-acetylphenyl)-3-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-yl)urea 1-(4-acetylphenyl)-3-(5,6-dihydr…

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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) 3.06 6.82 -17.72 2 5 0 71 301.371 3 ↓

Analogs

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Popular Name: 1-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-yl)-3-[3-[(1S)-1-hydroxyethyl]phenyl]urea 1-(5,6-dihydro-4H-cyclopenta[d]t…

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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) 2.71 4.6 -17.22 3 5 0 74 303.387 3 ↓

Analogs

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Popular Name: 1-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-yl)-3-[3-[(1R)-1-hydroxyethyl]phenyl]urea 1-(5,6-dihydro-4H-cyclopenta[d]t…

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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) 2.71 4.56 -16.75 3 5 0 74 303.387 3 ↓

Analogs

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Popular Name: 1-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-yl)-3-[4-[(1S)-1-hydroxyethyl]phenyl]urea 1-(5,6-dihydro-4H-cyclopenta[d]t…

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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) 2.73 4.6 -17.28 3 5 0 74 303.387 3 ↓

Analogs

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Popular Name: 1-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-yl)-3-[4-[(1R)-1-hydroxyethyl]phenyl]urea 1-(5,6-dihydro-4H-cyclopenta[d]t…

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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) 2.73 4.56 -16.88 3 5 0 74 303.387 3 ↓

Analogs

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Popular Name: 1-[3-[(1S)-1-aminoethyl]phenyl]-3-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-yl)urea 1-[3-[(1S)-1-aminoethyl]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) 1.01 5.08 -58.24 5 5 1 82 303.411 3 ↓

Analogs

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Popular Name: 1-[3-[(1R)-1-aminoethyl]phenyl]-3-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-yl)urea 1-[3-[(1R)-1-aminoethyl]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) 1.01 5.08 -59.6 5 5 1 82 303.411 3 ↓

Analogs

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Popular Name: 1-[4-[(1S)-1-aminoethyl]phenyl]-3-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-yl)urea 1-[4-[(1S)-1-aminoethyl]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) 1.03 5.08 -52.52 5 5 1 82 303.411 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[4-[(1R)-1-aminoethyl]phenyl]-3-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-yl)urea 1-[4-[(1R)-1-aminoethyl]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) 1.03 5.08 -54.03 5 5 1 82 303.411 3 ↓

Parameters Provided:

ring.id = 584729
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 = 584729 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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