COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552396
Chemical Name: (9R,16S)-4-(acetylamino)-N-[2-(3,4-dimethoxyphenyl)ethyl]-12-oxo-1,9,10,12,16,16a-hexahydro-2H,8H-9,16-methanopyrido[2',1':4,5][1,5]diazocino[1,2-a]quinoline-1-carboxamide
Smiles: COc1ccc(cc1OC)CCNC(=O)C1Cc2cc(ccc2N2C1[C@@H]1C[C@H](C2)Cn2c1cccc2=O)NC(=O)C

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Molecular Weight: 556.66
Empirical Formula: C32H36N4O5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.615
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 100
Number of rings: 6

     

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