COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK611529
Chemical Name: 6'-hydroxy-7,9,9-trimethyl-3-nitro-3'-(propan-2-yl)-6a,7,8,9,10,11-hexahydro-2'H,5H-spiro[7,11-methanoazepino[1,2-a]quinoline-6,5'-pyrimidine]-2',4'(3'H)-dione
Smiles: CC(N1C(=O)N=C(C2(C1=O)Cc1cc(ccc1N1C2C2(C)CC1CC(C2)(C)C)[N+](=O)[O-])O)C

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Molecular Weight: 454.53
Empirical Formula: C24H30N4O5

Physical State: Dry powder
Available Amount: 260 mg

Lipinsky:
logP: 4.581
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 119
Number of rings: 5

     

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