COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK684960
Chemical Name: 2-amino-4-[5-(3-chlorophenyl)furan-2-yl]-7,7-dimethyl-5-oxo-1-[5-(propan-2-ylsulfanyl)-1,3,4-thiadiazol-2-yl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(c2nnc(s2)SC(C)C)C2=C(C1c1ccc(o1)c1cccc(c1)Cl)C(=O)CC(C2)(C)C

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Molecular Weight: 552.12
Empirical Formula: C27H26ClN5O2S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.906
Rotatable bonds: 4
H-donors: 2
H-acceptors: 2
PSA: 162
Number of rings: 5

     

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