COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL528474
Chemical Name: 1-[1-hydroxy-11-(4-hydroxy-3-methoxyphenyl)-3,3-dimethyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]propan-1-one
Smiles: CCC(=O)N1C(c2ccc(c(c2)OC)O)C2=C(O)CC(CC2=Nc2c1cccc2)(C)C

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Molecular Weight: 420.51
Empirical Formula: C25H28N2O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.206
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 82
Number of rings: 4

     

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