COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL124894
Chemical Name: ethyl[4-({1-[(2-chloro-4-fluorophenyl)amino]-1-oxopropan-2-yl}sulfanyl)-1H-1,5-benzodiazepin-2-yl]acetate
Smiles: CCOC(=O)CC1=CC(=Nc2c(N1)cccc2)SC(C(=O)Nc1ccc(cc1Cl)F)C

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Molecular Weight: 461.94
Empirical Formula: C22H21ClFN3O3S

Physical State: Dry powder
Available Amount: 112 mg

Lipinsky:
logP: 3.913
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 105
Number of rings: 3

     

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