COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK754372
Chemical Name: 2-amino-1-(4-bromophenyl)-4-(3,4-dimethoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(c2ccc(cc2)Br)C2=C(C1c1ccc(c(c1)OC)OC)C(=O)CC(C2)(C)C

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Molecular Weight: 508.41
Empirical Formula: C26H26BrN3O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.063
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 88
Number of rings: 4

     

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