COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL052655
Chemical Name: (4E)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-{5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-[4-(propan-2-yl)phenyl]pyrrolidine-2,3-dione
Smiles: CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C(C)C)c1nnc(s1)SCc1cccc2c1cccc2)/O

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Molecular Weight: 633.79
Empirical Formula: C36H31N3O4S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 9.399
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 146
Number of rings: 7

     

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