COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL444561
Chemical Name: 3,3-dimethyl-11-(1-methyl-1H-pyrrol-2-yl)-1-oxo-N-phenyl-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carbothioamide
Smiles: O=C1CC(C)(C)CC2=C1C(N(C(=S)Nc1ccccc1)c1c(N2)cccc1)c1cccn1C

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Molecular Weight: 456.61
Empirical Formula: C27H28N4OS

Physical State: Dry powder
Available Amount: 250 mg

Lipinsky:
logP: 4.245
Rotatable bonds: 1
H-donors: 2
H-acceptors: 1
PSA: 81
Number of rings: 5

     

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