COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL041360
Chemical Name: (3aR,6aS)-3-(2-chlorophenyl)-5-(4-methyl-3-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Smiles: O=C1N(c2ccc(c(c2)[N+](=O)[O-])C)C(=O)[C@@H]2[C@H]1C(=NO2)c1ccccc1Cl

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Molecular Weight: 385.76
Empirical Formula: C18H12ClN3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.712
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 104
Number of rings: 4

     

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