COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK557598
Chemical Name: (3aR,6aS)-3-(4-bromophenyl)-5-(5-methoxy-2-methyl-4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: COc1cc(c(cc1[N+](=O)[O-])C)N1C(=O)[C@@H]2[C@H](C1=O)C(=NO2)c1ccc(cc1)Br

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Molecular Weight: 460.24
Empirical Formula: C19H14BrN3O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.67
Rotatable bonds: 1
H-donors: 0
H-acceptors: 6
PSA: 114
Number of rings: 4

     

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