COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK561915
Chemical Name: 1-[1-hydroxy-11-(3-methoxy-4-propoxyphenyl)-3,3-dimethyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]propan-1-one
Smiles: CCCOc1ccc(cc1OC)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)CC)cccc2)(C)C

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Molecular Weight: 462.59
Empirical Formula: C28H34N2O4

Physical State: Dry powder
Available Amount: 322 mg

Lipinsky:
logP: 6.038
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 71
Number of rings: 4

     

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