COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL540260
Chemical Name: N-[(7S)-10-({(2S)-1-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-1-oxopropan-2-yl}amino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide
Smiles: COc1cc2CC[C@@H](c3c(c2c(c1OC)OC)ccc(c(=O)c3)N[C@H](C(=O)N1CCN(CC1)C(=O)c1ccco1)C)NC(=O)C

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Molecular Weight: 618.69
Empirical Formula: C33H38N4O8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.937
Rotatable bonds: 6
H-donors: 2
H-acceptors: 8
PSA: 139
Number of rings: 5

     

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