COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK534477
Chemical Name: (1S,2R)-2-[({4-[bis(2-chloroethyl)amino]phenyl}acetyl)amino]-3-ethoxy-3-oxo-1-phenylpropyldodecanoate
Smiles: CCCCCCCCCCCC(=O)O[C@H]([C@H](C(=O)OCC)NC(=O)Cc1ccc(cc1)N(CCCl)CCCl)c1ccccc1

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Molecular Weight: 649.7
Empirical Formula: C35H50Cl2N2O5

Physical State: Dry powder
Available Amount: 112 mg

Lipinsky:
logP: 10.05
Rotatable bonds: 20
H-donors: 1
H-acceptors: 5
PSA: 84
Number of rings: 2

     

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