COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL169088
Chemical Name: 2-{[(E)-{4-[bis(2-chloroethyl)amino]phenyl}methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Smiles: ClCCN(c1ccc(cc1)/C=N/c1sc2c(c1C#N)CCCC2)CCCl

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Molecular Weight: 406.38
Empirical Formula: C20H21Cl2N3S

Physical State: Dry powder
Available Amount: 40 mg

Lipinsky:
logP: 5.052
Rotatable bonds: 4
H-donors: 0
H-acceptors: 0
PSA: 67
Number of rings: 3

     

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