COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL529618
Chemical Name: trans-N-(1,3-benzodioxol-5-yl)-4-[(L-methionylamino)methyl]cyclohexanecarboxamide
Smiles: CSCC[C@@H](C(=O)NC[C@@H]1CC[C@H](CC1)C(=O)Nc1ccc2c(c1)OCO2)N

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Saltdata: HCl
Molecular Weight: 407.53
Empirical Formula: C20H29N3O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.916
Rotatable bonds: 4
H-donors: 4
H-acceptors: 4
PSA: 127
Number of rings: 3

     

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