COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL549725
Chemical Name: (1S,5R)-3-[(2-chloro-3-hydroxy-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-4-yl)methyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Smiles: Clc1cc2c(c(c1O)CN1C[C@H]3C[C@@H](C1)c1n(C3)c(=O)ccc1)oc(=O)c1c2CCCC1

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Molecular Weight: 452.94
Empirical Formula: C25H25ClN2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.884
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 70
Number of rings: 6

     

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