COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL536456
Chemical Name: N-[(2Z)-3,4,5,6,7,8-hexahydro-2H-cyclohepta[d][1,3]thiazol-2-ylidene]-5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide
Smiles: O=C1N[C@@H]2[C@H](N1)[C@@H](SC2)CCCCC(=O)/N=c/1\sc2c([nH]1)CCCCC2

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Molecular Weight: 394.56
Empirical Formula: C18H26N4O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.08
Rotatable bonds: 4
H-donors: 3
H-acceptors: 2
PSA: 133
Number of rings: 4

     

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