COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK526087
Chemical Name: 2,5-bis{[bis(2-chloroethyl)amino]methyl}-1,6-bis(4-methoxyphenyl)hexane-1,6-dione
Smiles: ClCCN(CC(C(=O)c1ccc(cc1)OC)CCC(C(=O)c1ccc(cc1)OC)CN(CCCl)CCCl)CCCl

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Saltdata: 2 HCl
Molecular Weight: 634.47
Empirical Formula: C30H40Cl4N2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.518
Rotatable bonds: 15
H-donors: 0
H-acceptors: 4
PSA: 59
Number of rings: 2

     

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