COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL550850
Chemical Name: (1R,5R)-3-{[(3-benzyl-4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-5-yl)oxy]acetyl}-9-nitro-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Smiles: O=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)c(cc1)[N+](=O)[O-])COc1cc2OC(C)(C)CCc2c2c1c(C)c(Cc1ccccc1)c(=O)o2

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Molecular Weight: 625.68
Empirical Formula: C35H35N3O8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.843
Rotatable bonds: 4
H-donors: 0
H-acceptors: 8
PSA: 131
Number of rings: 7

     

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