COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK756309
Chemical Name: (2S,4aR,6aS,6bS)-6b-[(1E)-N-(acetyloxy)ethanimidoyl]-4a,6a-dimethyl-1,2,3,4,4a,4b,5,6,6a,6b,7,7a,8,8a,8b,9-hexadecahydrocyclopropa[3,4]cyclopenta[1,2-a]phenanthren-2-ylacetate
Smiles: CC(=O)O/N=C(/[C@@]12CC1CC1[C@]2(C)CCC2C1CC=C1[C@]2(C)CC[C@@H](C1)OC(=O)C)\C

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Molecular Weight: 427.58
Empirical Formula: C26H37NO4

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 5.483
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 64
Number of rings: 5

     

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