COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL042472
Chemical Name: methyl4-[10-(ethylcarbamothioyl)-1-hydroxy-3,3-dimethyl-3,4,10,11-tetrahydro-2H-dibenzo[b,e][1,4]diazepin-11-yl]benzoate
Smiles: CCNC(=S)N1C(c2ccc(cc2)C(=O)OC)C2=C(O)CC(CC2=Nc2c1cccc2)(C)C

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Molecular Weight: 463.6
Empirical Formula: C26H29N3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.176
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 106
Number of rings: 4

     

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