COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK320242
Chemical Name: 11-(4-chlorophenyl)-10-(thiophen-2-ylacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: Clc1ccc(cc1)C1C2=C(CCCC2=O)Nc2c(N1C(=O)Cc1cccs1)cccc2

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Molecular Weight: 448.97
Empirical Formula: C25H21ClN2O2S

Physical State: Dry powder
Available Amount: 162 mg

Lipinsky:
logP: 4.89
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 77
Number of rings: 5

     

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