COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL529429
Chemical Name: 3-(2-{[({[(3E,8xi,9xi,14xi,17beta)-17-hydroxy-17-methylandrosta-1,4-dien-3-ylidene]amino}oxy)acetyl]amino}ethyl)-5-methoxy-1H-indole-2-carboxylicacid
Smiles: COc1ccc2c(c1)c(CCNC(=O)CO/N=C/1\C=C[C@]3(C(=C1)CCC1C3CC[C@]3(C1CC[C@]3(C)O)C)C)c([nH]2)C(=O)O

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Molecular Weight: 589.73
Empirical Formula: C34H43N3O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.233
Rotatable bonds: 10
H-donors: 4
H-acceptors: 6
PSA: 133
Number of rings: 6

     

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