COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK044314
Chemical Name: 6-(1,5-dimethyl-1H-pyrazol-4-yl)-5-hexanoyl-9,9-dimethyl-5,6,8,9,10,11-hexahydro-7H-dibenzo[b,e]azepin-7-one
Smiles: CCCCCC(=O)N1c2ccccc2CC2=C(C1c1cnn(c1C)C)C(=O)CC(C2)(C)C

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Molecular Weight: 433.59
Empirical Formula: C27H35N3O2

Physical State: Dry powder
Available Amount: 34 mg

Lipinsky:
logP: 5.57
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 55
Number of rings: 4

     

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