COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL410859
Chemical Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-4-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyrazin-6-yl)butanamide
Smiles: CSCCC(c1nc2c([nH]1)cccc2)NC(=O)CCCN1C(=O)c2c(C1=O)nccn2

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Molecular Weight: 438.51
Empirical Formula: C21H22N6O3S

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 0.882
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 146
Number of rings: 4

     

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