COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK675697
Chemical Name: 8-amino-5-(2,3-dimethoxyphenyl)-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: COc1c(OC)cccc1C1C2=C(CC(CC2=O)(C)C)n2c(=C1C#N)nc(c1c2sc2c1CCCCC2)N

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Molecular Weight: 528.68
Empirical Formula: C30H32N4O3S

Physical State: Dry powder
Available Amount: 12 mg

Lipinsky:
logP: 4.873
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 129
Number of rings: 6

     

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