COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK631833
Chemical Name: 1,4-dihydroxy-5,8-bis({2-[(2-hydroxyethyl)amino]ethyl}amino)anthracene-9,10-dione
Smiles: OCCNCCNc1ccc(c2c1C(=O)c1c(C2=O)c(O)ccc1O)NCCNCCO

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Saltdata: HCl
Molecular Weight: 444.49
Empirical Formula: C22H28N4O6

Physical State: Dry powder
Available Amount: 313 mg

Lipinsky:
logP: 0.451
Rotatable bonds: 14
H-donors: 8
H-acceptors: 6
PSA: 163
Number of rings: 3

     

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