COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK685768
Chemical Name: 9-(morpholin-4-yl)-8-nitro-1'-{1-[(3s,5s,7s)-tricyclo[3.3.1.1~3,7~]dec-1-yl]ethyl}-1,2,4,4a-tetrahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: O=C1NC(=O)C2(C(=O)N1C(C13C[C@@H]4C[C@H](C3)C[C@H](C1)C4)C)Cc1cc([N+](=O)[O-])c(cc1N1C2COCC1)N1CCOCC1

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Molecular Weight: 593.68
Empirical Formula: C31H39N5O7

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.059
Rotatable bonds: 1
H-donors: 1
H-acceptors: 7
PSA: 137
Number of rings: 9

     

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