COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK675765
Chemical Name: 8-amino-5-(1,3-benzodioxol-5-yl)-2,2-dimethyl-4-oxo-1,3,4,5,10,11,12,13-octahydro-2H,9H-cyclohepta[4',5']thieno[3',2':5,6]pyrimido[1,2-a]quinoline-6-carbonitrile
Smiles: N#CC1=c2nc(N)c3c(n2C2=C(C1c1ccc4c(c1)OCO4)C(=O)CC(C2)(C)C)sc1c3CCCCC1

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Molecular Weight: 512.63
Empirical Formula: C29H28N4O3S

Available Amount: 0 mg

Lipinsky:
logP: 4.998
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 129
Number of rings: 7

     

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