COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552501
Chemical Name: (2R,3'E,6'R)-7-chloro-4,6-dimethoxy-3'-[({1-[3-(2-methoxyethyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)propyl}amino)methylidene]-6'-methyl-2'H,3H,4'H-spiro[1-benzofuran-2,1'-cyclohexane]-2',3,4'-trio
Smiles: COCCc1noc(n1)C(N/C=C/1\C(=O)C[C@H]([C@@]2(C1=O)Oc1c(C2=O)c(OC)cc(c1Cl)OC)C)CCSC

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Molecular Weight: 580.06
Empirical Formula: C26H30ClN3O8S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.26
Rotatable bonds: 10
H-donors: 1
H-acceptors: 8
PSA: 164
Number of rings: 4

     

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