COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552520
Chemical Name: 4-[2-({(E)-[(2R,6'R)-7-chloro-4,6-dimethoxy-6'-methyl-2',3,4'-trioxo-3H,3'H-spiro[1-benzofuran-2,1'-cyclohexan]-3'-ylidene]methyl}amino)ethyl]benzenesulfonamide
Smiles: COc1cc(OC)c(c2c1C(=O)[C@]1(O2)[C@H](C)CC(=O)/C(=C\NCCc2ccc(cc2)S(=O)(=O)N)/C1=O)Cl

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Molecular Weight: 549
Empirical Formula: C25H25ClN2O8S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.119
Rotatable bonds: 4
H-donors: 3
H-acceptors: 8
PSA: 159
Number of rings: 4

     

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