COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK375008
Chemical Name: dimethyl15,15'-methanediylbis[4-(acetyloxy)-3-hydroxy-16-methoxy-1-methyl-6,7-didehydroaspidospermidine-3-carboxylate]
Smiles: COC(=O)C1(O)C(OC(=O)C)C2(CC)C=CCN3C2C2(C1N(C)c1c2cc(c(c1)OC)Cc1cc2c(cc1OC)N(C1C42CCN2C4C(CC)(C=CC2)C(C1(O)C(=O)OC)OC(=O)C)C)CC3

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Molecular Weight: 925.09
Empirical Formula: C51H64N4O12

Physical State: Dry powder
Available Amount: 184 mg

Lipinsky:
logP: 4.163
Rotatable bonds: 16
H-donors: 2
H-acceptors: 12
PSA: 177
Number of rings: 10

     

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