COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK687590
Chemical Name: 8-amino-5-(1,3-benzodioxol-5-yl)-4-oxo-1,3,4,5,10,11-hexahydro-2H,9H-9,12-ethanopyrido[3'',2'':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)CCC2)sc1c3C2CCN1CC2

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Molecular Weight: 497.58
Empirical Formula: C27H23N5O3S

Physical State: Dry powder
Available Amount: 59 mg

Lipinsky:
logP: 2.52
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 132
Number of rings: 9

     

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