COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL527424
Chemical Name: methyl(7S,10aR)-1,4-dimethoxy-7,10a-dimethyl-13-(propan-2-yl)-6,6a,7,8,9,10,10a,10b,11,12-decahydro-5H-4b,12-ethenochrysene-7-carboxylate
Smiles: COC(=O)[C@@]1(C)CCC[C@]2(C1CCC13C2CC(C(=C1)C(C)C)c1c3c(OC)ccc1OC)C

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Molecular Weight: 452.63
Empirical Formula: C29H40O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.228
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 44
Number of rings: 6

     

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