COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL528464
Chemical Name: 1-{1-hydroxy-3,3-dimethyl-11-[(2,2,3-trimethylcyclopent-3-en-1-yl)methyl]-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl}propan-1-one
Smiles: CCC(=O)N1C(CC2CC=C(C2(C)C)C)C2=C(O)CC(CC2=Nc2c1cccc2)(C)C

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Molecular Weight: 420.6
Empirical Formula: C27H36N2O2

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 7.112
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 52
Number of rings: 4

     

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