COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK785107
Chemical Name: 6-(1,1-dioxidotetrahydrothiophen-3-yl)-1-methyl-4-(3-nitrophenyl)-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Smiles: O=C1NC(c2cccc(c2)[N+](=O)[O-])C2=C(N1C)CN(C2=O)C1CCS(=O)(=O)C1

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Molecular Weight: 406.42
Empirical Formula: C17H18N4O6S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: -0.634
Rotatable bonds: 2
H-donors: 1
H-acceptors: 6
PSA: 140
Number of rings: 4

     

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