COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK790982
Chemical Name: 6'-amino-5-bromo-2-oxo-2'-propyl-1,1',2,2',3',8a'-hexahydro-7'H-spiro[indole-3,8'-isoquinoline]-5',7',7'-tricarbonitrile
Smiles: CCCN1CC=C2C(C1)C1(C(=O)Nc3c1cc(Br)cc3)C(C(=C2C#N)N)(C#N)C#N

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Molecular Weight: 463.34
Empirical Formula: C22H19BrN6O

Physical State: Dry powder
Available Amount: 221 mg

Lipinsky:
logP: 5.279
Rotatable bonds: 2
H-donors: 3
H-acceptors: 1
PSA: 129
Number of rings: 4

     

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