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. 2025 Nov 29;16:545. doi: 10.1038/s41598-025-30119-w

Table 4.

Molecular descriptors of the selected bioactive compounds.

Molecular descriptors Esculetin Aloe emodin Chrysophanic acid Aloesin
Molecular weight 178.143 270.24 254.241 394.376
LogP 1.2042 1.3655 2.18162 −0.54658
#Rotatable bonds 0 1 0 4
#Acceptors 4 5 4 9
#Donors 2 3 2 5
Surface area 72.668 113.283 108.489 158.969

# = Number of