COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL407228
Chemical Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-4-(1,3-dioxo-1,3-dihydro-2H-pyrrolo[3,4-c]pyridin-2-yl)butanamide
Smiles: CSCCC(c1[nH]c2c(n1)cccc2)NC(=O)CCCN1C(=O)c2c(C1=O)cncc2

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Molecular Weight: 437.52
Empirical Formula: C22H23N5O3S

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 1.887
Rotatable bonds: 8
H-donors: 2
H-acceptors: 3
PSA: 133
Number of rings: 4

     

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