Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
Type:
UnknownAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
Type:
UnknownAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS- ALA4102525
Name:
(S)-5-Benzyl-1-(2-(pyridin-3-yl)ethyl)imidazolidin-2-imineMol. Formula:
C17H20N4M.W.:
280.38Type:
Small moleculeAlogP:
2.08Polar Surface Area:
52.01HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.88DETAILS -
Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS - ALA4100236
Name:
1-(2-(6-Chloropyridin-3-yl)ethyl)imidazolidin-2-imineMol. Formula:
C10H13ClN4M.W.:
224.69Type:
Small moleculeAlogP:
1.12Polar Surface Area:
52.01HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
YQED Weighted:
0.76DETAILS - ALA4100067
Name:
(S)-5-Isopropyl-1-(2-(pyridin-3-yl)ethyl)imidazolidin-2-imineMol. Formula:
C13H20N4M.W.:
232.33Type:
Small moleculeAlogP:
1.49Polar Surface Area:
52.01HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.83DETAILS -
Type:
Small moleculeAlogP:
3.41Polar Surface Area:
18.46HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.81DETAILS -
Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS - ALA4098322
Name:
(S)-5-(2-(Methylthio)ethyl)-1-(2-(pyridin-3-yl)ethyl)-imidazolidin-2-imineMol. Formula:
C13H20N4SM.W.:
264.40Type:
Small moleculeAlogP:
1.59Polar Surface Area:
52.01HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.82DETAILS -
Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS - ALA4094784
Name:
(S)-5-Isobutyl-1-(2-(pyridin-3-yl)ethyl)imidazolidin-2-imineMol. Formula:
C14H22N4M.W.:
246.36Type:
Small moleculeAlogP:
1.88Polar Surface Area:
52.01HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.83DETAILS - ALA4092845
Name:
6,7-Dimethoxy-2-ethyl-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium iodideMol. Formula:
C14H22INO2M.W.:
363.24Type:
Small moleculeAlogP:
2.23Polar Surface Area:
18.46HBA:
2HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
YQED Weighted:
0.75DETAILS -
Type:
Small moleculeAlogP:
1.83Polar Surface Area:
39.12HBA:
1HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
YQED Weighted:
0.88DETAILS -
Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
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