COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL033848
Chemical Name: 4-amino-3-{[3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy}-6-(ethylamino)-2-hydroxycyclohexyl3-deoxy-4-C-methyl-3-(methylamino)pentopyranoside
Smiles: CCNC1CC(N)C(C(C1OC1OCC(C(C1O)NC)(C)O)O)OC1OC(=CCC1N)CN

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Molecular Weight: 475.59
Empirical Formula: C21H41N5O7

Physical State: Dry powder
Available Amount: 1007 mg

Lipinsky:
logP: -1.901
Rotatable bonds: 11
H-donors: 11
H-acceptors: 7
PSA: 199
Number of rings: 3

     

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