COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK149715
Chemical Name: methyl4-[10-(ethylcarbamothioyl)-3,3-dimethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl]benzoate
Smiles: CCNC(=S)N1C(c2ccc(cc2)C(=O)OC)C2=C(Nc3c1cccc3)CC(CC2=O)(C)C

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Molecular Weight: 463.6
Empirical Formula: C26H29N3O3S

Physical State: Dry powder
Available Amount: 160 mg

Lipinsky:
logP: 4.313
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 102
Number of rings: 4

     

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