COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK083674
Chemical Name: (2E)-1-[11-(4-fluorophenyl)-1-hydroxy-3-(4-methoxyphenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-3-phenylprop-2-en-1-one
Smiles: COc1ccc(cc1)C1CC(=C2C(=Nc3ccccc3N(C2c2ccc(cc2)F)C(=O)/C=C/c2ccccc2)C1)O

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Molecular Weight: 544.63
Empirical Formula: C35H29FN2O3

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 7.271
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 62
Number of rings: 6

     

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