Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
Type:
Small moleculeAlogP:
5.13Polar Surface Area:
119.08HBA:
5HBD:
3#RO5 Violations:
1#Rotatable Bonds:
21Passes Ro3:
NQED Weighted:
0.16DETAILS
Type:
Small moleculeAlogP:
4.86Polar Surface Area:
75.99HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.46DETAILS
ALA33408Name:
8-(2,2,2-Trifluoro-acetyl)-naphthalene-2-carboxylic acidMol. Formula:
C13H7F3O3M.W.:
268.19Type:
Small moleculeAlogP:
3.28Polar Surface Area:
54.37HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.85DETAILS
ALA33440Name:
8-(Hydroxy-octyloxy-phosphoryl)-naphthalene-2-carboxylic acidMol. Formula:
C19H25O5PM.W.:
364.38Type:
Small moleculeAlogP:
4.73Polar Surface Area:
83.83HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.47DETAILS- ALA34162
Name:
8-(Hydroxy-octadecyloxy-phosphoryl)-naphthalene-2-carboxylic acidMol. Formula:
C29H45O5PM.W.:
504.65Type:
Small moleculeAlogP:
8.63Polar Surface Area:
83.83HBA:
3HBD:
2#RO5 Violations:
2#Rotatable Bonds:
20Passes Ro3:
NQED Weighted:
0.14DETAILS - ALA280817
Name:
(E)-3-[4-Benzyloxy-2-(decyloxy-hydroxy-phosphoryl)-phenyl]-acrylic acidMol. Formula:
C26H35O6PM.W.:
474.53Type:
Small moleculeAlogP:
6.33Polar Surface Area:
93.06HBA:
4HBD:
2#RO5 Violations:
1#Rotatable Bonds:
16Passes Ro3:
NQED Weighted:
0.17DETAILS - ALA31185
Name:
4-Heptyloxy-3-(3,3,3-trifluoro-2-oxo-propyl)-benzoic acidMol. Formula:
C17H21F3O4M.W.:
346.35Type:
Small moleculeAlogP:
4.41Polar Surface Area:
63.60HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
10Passes Ro3:
NQED Weighted:
0.64DETAILS -
Type:
Small moleculeAlogP:
3.17Polar Surface Area:
43.37HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.63DETAILS -
Type:
Small moleculeAlogP:
3.17Polar Surface Area:
43.37HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.63DETAILS
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