COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK149714
Chemical Name: 4-{11-[4-(methoxycarbonyl)phenyl]-3,3-dimethyl-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl}-4-oxobutanoicacid
Smiles: COC(=O)c1ccc(cc1)C1C2=C(Nc3c(N1C(=O)CCC(=O)O)cccc3)CC(CC2=O)(C)C

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Molecular Weight: 476.53
Empirical Formula: C27H28N2O6

Physical State: Dry powder
Available Amount: 147 mg

Lipinsky:
logP: 3.627
Rotatable bonds: 5
H-donors: 2
H-acceptors: 6
PSA: 113
Number of rings: 4

     

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