COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK555010
Chemical Name: 1,7,7-trimethyl-4-[({[(2E)-1,7,7-trimethylbicyclo[2.2.1]hept-2-ylidene]amino}oxy)carbonyl]bicyclo[2.2.1]heptan-2-one
Smiles: O=C(C12CCC(C2(C)C)(C(=O)C1)C)O/N=C/1\CC2C(C1(C)CC2)(C)C

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Molecular Weight: 345.48
Empirical Formula: C21H31NO3

Physical State: Dry powder
Available Amount: 325 mg

Lipinsky:
logP: 3.603
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 55
Number of rings: 4

     

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