COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552570
Chemical Name: 3-[(2S,6'R)-7-chloro-2'-hydroxy-4,6-dimethoxy-6'-methyl-3,4'-dioxo-3H-spiro[1-benzofuran-2,1'-cyclohex[2]en]-3'-yl]-N-[2-(5-methoxy-2-oxo-2,3-dihydro-1H-indol-3-yl)ethyl]-3-[4-(methylsulfanyl)phenyl]p
Smiles: CSc1ccc(cc1)C(C1=C(O)[C@]2([C@@H](CC1=O)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC)CC(=O)NCCC1C(=O)Nc2c1cc(OC)cc2

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Molecular Weight: 721.23
Empirical Formula: C37H37ClN2O9S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.509
Rotatable bonds: 10
H-donors: 3
H-acceptors: 9
PSA: 174
Number of rings: 6

     

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