COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK004901
Chemical Name: 11-(1,3-benzodioxol-5-yl)-3,3-dimethyl-10-(phenylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: O=C1CC(C)(C)CC2=C1C(c1ccc3c(c1)OCO3)N(C(=O)c1ccccc1)c1c(N2)cccc1

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Molecular Weight: 466.54
Empirical Formula: C29H26N2O4

Physical State: Dry powder
Available Amount: 611 mg

Lipinsky:
logP: 5.576
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 67
Number of rings: 6

     

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