COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL545199
Chemical Name: N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-[3-(1H-benzimidazol-2-yl)propyl]-L-valinamide
Smiles: COc1c(OC)cc2c(c1OC)c1ccc(c(=O)cc1[C@H](CC2)NC(=O)C)N[C@H](C(=O)NCCCc1nc2c([nH]1)cccc2)C(C)C

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Molecular Weight: 641.77
Empirical Formula: C36H43N5O6

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.897
Rotatable bonds: 8
H-donors: 4
H-acceptors: 6
PSA: 143
Number of rings: 5

     

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