COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL531978
Chemical Name: 3-[(3a'S,6a'R)-5'-(1,3-benzodioxol-5-ylmethyl)-5-ethyl-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]propanoicacid
Smiles: CCc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)Cc1ccc3c(c1)OCO3)CCC(=O)O)C(=O)N2

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Molecular Weight: 491.5
Empirical Formula: C26H25N3O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.27
Rotatable bonds: 7
H-donors: 3
H-acceptors: 7
PSA: 134
Number of rings: 6

     

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