COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK139479
Chemical Name: 10-hexanoyl-11-(3-methoxy-4-propoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCCCCC(=O)N1C(c2ccc(c(c2)OC)OCCC)C2=C(Nc3c1cccc3)CC(CC2=O)(C)C

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Molecular Weight: 504.67
Empirical Formula: C31H40N2O4

Physical State: Dry powder
Available Amount: 64 mg

Lipinsky:
logP: 6.769
Rotatable bonds: 9
H-donors: 1
H-acceptors: 4
PSA: 67
Number of rings: 4

     

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