COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK870379
Chemical Name: methyl4-[3,3-dicyano-1-(2,2-dimethylpropanoyl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinolin-2-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1C(N2C(C1(C#N)C#N)C=Cc1c2cccc1)C(=O)C(C)(C)C

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Molecular Weight: 439.51
Empirical Formula: C27H25N3O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.92
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 94
Number of rings: 4

     

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