COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK687114
Chemical Name: 1'-(2-methyl-5-nitrophenyl)-2,5'-dioxo-1-(prop-2-yn-1-yl)-2'-(1H-pyrrol-1-yl)-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Smiles: C#CCN1c2ccccc2C2(C1=O)C(=C(n1cccc1)N(C1=C2C(=O)CCC1)c1cc(ccc1C)[N+](=O)[O-])C#N

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Molecular Weight: 529.55
Empirical Formula: C31H23N5O4

Physical State: Dry powder
Available Amount: 80 mg

Lipinsky:
logP: 5.816
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 115
Number of rings: 6

     

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