COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL527243
Chemical Name: (3S,11E)-14-{2-hydroxy-3-[(1R,5S)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]propoxy}-16-methoxy-3-methyl-3,4,5,6,9,10-hexahydro-1H-2-benzoxacyclotetradecine-1,7(8H)-di
Smiles: COc1cc(OCC(CN2C[C@H]3C[C@@H](C2)c2n(C3)c(=O)ccc2)O)cc2c1C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/2

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Saltdata: HCl
Molecular Weight: 578.71
Empirical Formula: C33H42N2O7

Physical State: Dry powder
Available Amount: 59 mg

Lipinsky:
logP: 3.319
Rotatable bonds: 7
H-donors: 1
H-acceptors: 7
PSA: 105
Number of rings: 5

     

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