COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL333705
Chemical Name: methyl4-[({[6-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl}acetyl)amino]benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CSc1nc2c(s1)cc(cc2)N1C(=O)C2C(C1=O)C1CC2C=C1

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Molecular Weight: 519.6
Empirical Formula: C26H21N3O5S2

Physical State: Dry powder
Available Amount: 64 mg

Lipinsky:
logP: 3.845
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 159
Number of rings: 6

     

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