Citation: Fan Xiaoling, Zhu Minhui*, Fu Heng. THE CONFORMATIONAL ANALYSIS OF 4′-R-3,3-DIALKYLPHENYL-TRIAZENES ON ANTITUMOR POTENCY[J]. Acta Physico-Chimica Sinica, ;1989, 5(04): 392-394. doi: 10.3866/PKU.WHXB19890403
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Using the MMPI program and 3-D high resolution molecular modeling system, a preliminary structure-activity relationship (SAR) based upon molecular shape analysis has been developed for a set of 20 4-R-3, 3-dialkylphenyl-triazenes for which antitumor potency against L1712 Leukemia in mice is reported. The SAR suggests that for antitumor potency, here is a significant difference between the shapes of the active and inactive molecules.
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