COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL553126
Chemical Name: 4-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl}-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one
Smiles: O=C(C12CCC(C2(C)C)(C(=O)C1)C)N1CCN(CC1)Cc1ccc2c(c1)OCO2

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Molecular Weight: 398.5
Empirical Formula: C23H30N2O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.281
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 59
Number of rings: 5

     

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