COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL532955
Chemical Name: methyl2-[(3R,3'S,3a'S,6a'R)-3'-benzyl-6-chloro-7-methyl-2,4',6'-trioxo-1,2,2',3',3a',4',6',6a'-octahydro-5'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-5'-yl]benzoate
Smiles: COC(=O)c1ccccc1N1C(=O)[C@H]2[C@@H](C1=O)[C@]1(N[C@H]2Cc2ccccc2)C(=O)Nc2c1ccc(c2C)Cl

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Molecular Weight: 529.98
Empirical Formula: C29H24ClN3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.368
Rotatable bonds: 2
H-donors: 2
H-acceptors: 5
PSA: 104
Number of rings: 6

     

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