COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL052168
Chemical Name: (4E)-5-[4-(benzyloxy)-3-methoxyphenyl]-1-(6-chloro-1,3-benzothiazol-2-yl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Smiles: COc1cc(ccc1OCc1ccccc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)Cl

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Molecular Weight: 641.1
Empirical Formula: C34H25ClN2O7S

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 7.372
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 135
Number of rings: 7

     

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