COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK998593
Chemical Name: (8S)-6-amino-8-[3-methoxy-4-(propan-2-yloxy)phenyl]-2-propyl-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Smiles: CCCN1CC=C2C(C1)[C@@H](c1ccc(c(c1)OC)OC(C)C)C(C(=C2C#N)N)(C#N)C#N

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Molecular Weight: 431.54
Empirical Formula: C25H29N5O2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.031
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 119
Number of rings: 3

     

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