COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL059136
Chemical Name: 3,12-bis[3-(diethylamino)-2-hydroxypropyl]-3,12-diaza-6,9-diazoniadispiro[5.2.5.2]hexadecane
Smiles: CCN(CC(CN1CC[N+]2(CC1)CC[N+]1(CC2)CCN(CC1)CC(CN(CC)CC)O)O)CC

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Saltdata: 2 Cl-, 3 H2O
Molecular Weight: 484.77
Empirical Formula: C26H56N6O2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 1.006
Rotatable bonds: 10
H-donors: 2
H-acceptors: 2
PSA: 53
Number of rings: 3

     

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