COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL059056
Chemical Name: N,N,N',N',N'',N'',N''',N'''-octaethyl-1,21,23,25-tetrahexyl-1H,21H,23H,25H-19,3:20,2-di(metheno)[1,3,2]benzodioxaphosphocino[9',8':4,5][1,3,2]benzodioxaphosphocino[9,8-d][1,3,2]dioxaphosphocino[5,4-i]
Smiles: CCCCCCC1c2cc3c4cc2OP(Oc2c1cc1c(c2)OP(Oc2c(C1CCCCCC)cc1C(c5cc(C3CCCCCC)c(OP(O4)N(CC)CC)cc5OP(Oc1c2)N(CC)CC)CCCCCC)N(CC)CC)N(CC)CC

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Molecular Weight: 1229.49
Empirical Formula: C68H104N4O8P4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 22.618
Rotatable bonds: 28
H-donors: 0
H-acceptors: 8
PSA: 141
Number of rings: 8

     

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