COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL533467
Chemical Name: (3a'S,6a'R)-7-chloro-5'-(2,3-dihydro-1,4-benzodioxin-6-yl)-3'-(3,4-dihydroxybenzyl)-5-methyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: Cc1cc(Cl)c2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)c1ccc3c(c1)OCCO3)Cc1ccc(c(c1)O)O)C(=O)N2

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Molecular Weight: 561.98
Empirical Formula: C29H24ClN3O7

Physical State: Dry powder
Available Amount: 58 mg

Lipinsky:
logP: 2.9
Rotatable bonds: 4
H-donors: 4
H-acceptors: 7
PSA: 137
Number of rings: 7

     

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