COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL505351
Chemical Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[4-(diphenylmethyl)piperazin-1-yl]butan-1-one
Smiles: O=C(c1ccc2c(c1)OCCO2)CCCN1CCN(CC1)C(c1ccccc1)c1ccccc1

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Molecular Weight: 456.58
Empirical Formula: C29H32N2O3

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.05
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 42
Number of rings: 5

     

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