COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK067708
Chemical Name: 11-(2-butoxyphenyl)-3-(4-chlorophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCCCOc1ccccc1C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccc(cc1)Cl

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Molecular Weight: 473.01
Empirical Formula: C29H29ClN2O2

Physical State: Dry powder
Available Amount: 642 mg

Lipinsky:
logP: 6.148
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 50
Number of rings: 5

     

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