COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL438744
Chemical Name: 11-(4-methoxyphenyl)-10-propanoyl-3-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: COc1ccc(cc1)C1C2=C(CC(CC2=O)c2cccs2)Nc2c(N1C(=O)CC)cccc2

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Molecular Weight: 458.58
Empirical Formula: C27H26N2O3S

Physical State: Dry powder
Available Amount: 329 mg

Lipinsky:
logP: 4.6
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 86
Number of rings: 5

     

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