COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK292730
Chemical Name: (2E,2'E)-N,N'-(tricyclo[3.3.1.1~3,7~]decane-1,3-diyldimethanediyl)bis[3-(4-nitrophenyl)prop-2-enamide]
Smiles: O=C(/C=C/c1ccc(cc1)[N+](=O)[O-])NCC12CC3CC(C1)CC(C2)(C3)CNC(=O)/C=C/c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 544.61
Empirical Formula: C30H32N4O6

Physical State: Dry powder
Available Amount: 63 mg

Lipinsky:
logP: 5.064
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 149
Number of rings: 6

     

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