COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK741909
Chemical Name: 3-(4-butoxyphenyl)-10-hexanoyl-11-phenyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCCCCC(=O)N1c2ccccc2NC2=C(C1c1ccccc1)C(=O)CC(C2)c1ccc(cc1)OCCCC

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Molecular Weight: 536.71
Empirical Formula: C35H40N2O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.11
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 58
Number of rings: 5

     

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