COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK689516
Chemical Name: (8xi,17beta)-17-(acetyloxy)-17-ethynylestra-1,3,5(10)-trien-3-yl{4-[bis(2-chloroethyl)amino]phenyl}acetate
Smiles: ClCCN(c1ccc(cc1)CC(=O)Oc1ccc2c(c1)CCC1[C@@H]2CC[C@]2([C@H]1CC[C@]2(C#C)OC(=O)C)C)CCCl

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Molecular Weight: 596.59
Empirical Formula: C34H39Cl2NO4

Physical State: Dry powder
Available Amount: 73 mg

Lipinsky:
logP: 7.622
Rotatable bonds: 9
H-donors: 0
H-acceptors: 4
PSA: 55
Number of rings: 5

     

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