COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK537605
Chemical Name: 3-amino-1,1-bis(ethylsulfanyl)-4-phenyl-5,6,7,8-tetrahydrocyclopenta[b]pyrrolo[3,4-d]pyridine-3a,8b(1H,4H)-dicarbonitrile
Smiles: CCSC1(SCC)N=C(C2(C1(C#N)C1=C(CCC1)NC2c1ccccc1)C#N)N

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Molecular Weight: 423.61
Empirical Formula: C22H25N5S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.506
Rotatable bonds: 4
H-donors: 3
H-acceptors: 0
PSA: 148
Number of rings: 4

     

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