COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL092844
Chemical Name: prop-2-en-1-yl3-(3-chlorophenyl)-10-methoxy-2-methyl-4-thioxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3,5-benzoxadiazocine-11-carboxylate
Smiles: C=CCOC(=O)C1C2NC(=S)N(C1(C)Oc1c2cccc1OC)c1cccc(c1)Cl

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Molecular Weight: 444.94
Empirical Formula: C22H21ClN2O4S

Physical State: Dry powder
Available Amount: 121 mg

Lipinsky:
logP: 5.038
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 92
Number of rings: 4

     

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