COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL531552
Chemical Name: ethyl4-[(3R,3'S,3a'S,6a'R)-3'-(2-amino-2-oxoethyl)-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: CCOC(=O)c1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@]1(N[C@H]2CC(=O)N)C(=O)Nc2c1cccc2

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Molecular Weight: 462.46
Empirical Formula: C24H22N4O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.306
Rotatable bonds: 3
H-donors: 4
H-acceptors: 6
PSA: 147
Number of rings: 5

     

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