COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK570365
Chemical Name: 8-bromo-10,10-dimethyl-10a-[(E)-2-(3-nitrophenyl)ethenyl]-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Smiles: O=C1CCN2C(N1)(/C=C/c1cccc(c1)[N+](=O)[O-])C(C)(C)c1c2ccc(c1)Br

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Molecular Weight: 442.31
Empirical Formula: C21H20BrN3O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.098
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 78
Number of rings: 4

     

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