COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK000274
Chemical Name: (2E)-3-(4-chloro-3-nitrophenyl)-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbamothioyl)prop-2-enamide
Smiles: S=C(NC12CC3CC(C2)CC(C1)C3)NC(=O)/C=C/c1ccc(c(c1)[N+](=O)[O-])Cl

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Molecular Weight: 419.93
Empirical Formula: C20H22ClN3O3S

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 5.143
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 119
Number of rings: 5

     

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