COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL543810
Chemical Name: (1S,5S)-N-[(2S)-1-{[2-(5-methoxy-1H-indol-3-yl)ethyl]amino}-3-methyl-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: COc1ccc2c(c1)c(CCNC(=O)[C@H](C(C)C)NC(=O)N1C[C@H]3C[C@@H](C1)c1n(C3)c(=O)ccc1)c[nH]2

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Molecular Weight: 505.62
Empirical Formula: C28H35N5O4

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 2.051
Rotatable bonds: 6
H-donors: 3
H-acceptors: 4
PSA: 106
Number of rings: 5

     

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