COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL535784
Chemical Name: {6-[(2-methylpropanoyl)amino]-1H-indol-3-yl}[(1S,5S)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]aceticacid
Smiles: CC(C(=O)Nc1ccc2c(c1)[nH]cc2C(N1C[C@@H]2C[C@H](C1)c1n(C2)c(=O)ccc1)C(=O)O)C

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Molecular Weight: 448.52
Empirical Formula: C25H28N4O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.464
Rotatable bonds: 5
H-donors: 3
H-acceptors: 4
PSA: 105
Number of rings: 5

     

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