COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL491913
Chemical Name: N-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)-4-(methylsulfanyl)-2-(1H-pyrrol-1-yl)butanamide
Smiles: CSCCC(n1cccc1)C(=O)NCC1COc2c(O1)cccc2

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Molecular Weight: 346.45
Empirical Formula: C18H22N2O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.514
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 77
Number of rings: 3

     

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