COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL538061
Chemical Name: (1S,5S)-N-[(2S)-1-[(3,5-dimethoxyphenyl)amino]-4-(methylsulfanyl)-1-oxobutan-2-yl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Smiles: CSCC[C@@H](C(=O)Nc1cc(OC)cc(c1)OC)NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1

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Molecular Weight: 500.62
Empirical Formula: C25H32N4O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.561
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 125
Number of rings: 4

     

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