COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL564429
Chemical Name: (5alpha,8xi,14xi,16xi,17xi)-3-hydroxyspirost-9(11)-en-12-one
Smiles: CC1CC[C@@]2(OC1)OC1C([C@@H]2C)[C@@]2(C(C1)C1CC[C@@H]3[C@](C1=CC2=O)(C)CCC(C3)O)C

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Molecular Weight: 428.61
Empirical Formula: C27H40O4

Physical State: Dry powder
Available Amount: 9 mg

Lipinsky:
logP: 3.982
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 55
Number of rings: 6

     

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