COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL550606
Chemical Name: 3,4-dimethoxy-6-(2-{[(1S,5S)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]sulfonyl}ethyl)-5H-indeno[1,2-c]isoquinoline-5,11(6H)-dione
Smiles: COc1ccc2c(c1OC)c(=O)n(c1c2C(=O)c2c1cccc2)CCS(=O)(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1

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Molecular Weight: 587.65
Empirical Formula: C31H29N3O7S

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 2.429
Rotatable bonds: 5
H-donors: 0
H-acceptors: 7
PSA: 121
Number of rings: 7

     

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