COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK651978
Chemical Name: N,N-diethyl-2-[8-oxo-5-(piperidin-1-yl)-1,3,4,8-tetrahydro[1,2,3]triazino[4',5':4,5]thieno[2,3-c]isoquinolin-9(2H)-yl]acetamide
Smiles: CCN(C(=O)Cn1nnc2c(c1=O)sc1c2c2CCCCc2c(n1)N1CCCCC1)CC

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Molecular Weight: 454.6
Empirical Formula: C23H30N6O2S

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 4.94
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 109
Number of rings: 5

     

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