COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK673919
Chemical Name: (2R,3R,10bS)-2-[3-(methylsulfanyl)phenyl]-3-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)-2,3-dihydropyrrolo[2,1-a]isoquinoline-1,1(10bH)-dicarbonitrile
Smiles: N#CC1(C#N)[C@@H](c2cccc(c2)SC)[C@@H](N2[C@H]1c1ccccc1C=C2)C(=O)C12CC3CC(C2)CC(C1)C3

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Molecular Weight: 505.68
Empirical Formula: C32H31N3OS

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 7.59
Rotatable bonds: 1
H-donors: 0
H-acceptors: 1
PSA: 93
Number of rings: 8

     

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