COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL188634
Chemical Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl][3-(4-butoxyphenyl)-1H-pyrazol-5-yl]methanone
Smiles: CCCCOc1ccc(cc1)c1n[nH]c(c1)C(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

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Molecular Weight: 462.55
Empirical Formula: C26H30N4O4

Physical State: Dry powder
Available Amount: 20 mg

Lipinsky:
logP: 2.966
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 79
Number of rings: 5

     

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