COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK076573
Chemical Name: 3-(4-methoxyphenyl)-8-methyl-11-(thiophen-2-yl)-10-(trifluoroacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: COc1ccc(cc1)C1CC2=C(C(=O)C1)C(c1cccs1)N(c1c(N2)ccc(c1)C)C(=O)C(F)(F)F

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Molecular Weight: 512.55
Empirical Formula: C27H23F3N2O3S

Physical State: Dry powder
Available Amount: 87 mg

Lipinsky:
logP: 6.244
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 86
Number of rings: 5

     

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