COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL432562
Chemical Name: (2E)-2-(1,3-benzothiazol-2-yl)-3-[5-(1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)furan-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\c1ccc(o1)c1ccc2c(c1)C(=O)NC2=O)/c1nc2c(s1)cccc2

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Molecular Weight: 397.41
Empirical Formula: C22H11N3O3S

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 5.194
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 124
Number of rings: 5

     

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