COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL299828
Chemical Name: (1R,1'R,2S,4a'R,6a'R,6b'R,12a'R)-2',2',6a',6b',9',9',12a'-heptamethyl-2-(4-methyl-1,3-thiazol-5-yl)octadecahydro-2'H,10'H-spiro[cyclopropane-1,11'-[16]oxa[1,4a](epoxymethano)picen]-10'-one
Smiles: Cc1ncsc1[C@H]1C[C@]21C[C@@]1(C)C(C(C2=O)(C)C)CC[C@@]2(C1CCC1[C@@]2(C)CC[C@@]23C1[C@H](OC2)C(C)(C)CC3)C

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Molecular Weight: 563.89
Empirical Formula: C36H53NO2S

Physical State: Dry powder
Available Amount: 49 mg

Lipinsky:
logP: 8.95
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 67
Number of rings: 8

     

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