ALA1088864Name:
anti-1-amino-2-[18F]fluorocyclobutane-1-carboxylic acidMol. Formula:
C5H8FNO2M.W.:
132.12Type:
Small moleculeAlogP:
-0.10Polar Surface Area:
63.32HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.52DETAILS
ALA1085171Name:
(S)-3-Fluoro-2-methyl-2-(methylamino)propanoic Acid Hydrochloride SaltMol. Formula:
C5H11ClFNO2M.W.:
171.60Type:
Small moleculeAlogP:
0.02Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
YQED Weighted:
0.57DETAILS
ALA1085170Name:
(R)-3-Fluoro-2-methyl-2-(methylamino)propanoic Acid Hydrochloride SaltMol. Formula:
C5H11ClFNO2M.W.:
171.60Type:
Small moleculeAlogP:
0.02Polar Surface Area:
49.33HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
YQED Weighted:
0.57DETAILS
ALA1085169Name:
(S)-2-Amino-3-fluoro-2-methylpropanoic Acid Hydrochloride SaltMol. Formula:
C4H9ClFNO2M.W.:
157.57Type:
Small moleculeAlogP:
-0.24Polar Surface Area:
63.32HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.53DETAILS
ALA1077105Name:
(R)-2-Amino-3-fluoro-2-methylpropanoic Acid Hydrochloride SaltMol. Formula:
C4H9ClFNO2M.W.:
157.57Type:
Small moleculeAlogP:
-0.24Polar Surface Area:
63.32HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.53DETAILS- ALA398251
Name:
1-amino-3-[(123)I]-iodomethylene-cyclobutane-1-carboxylic acidMol. Formula:
C6H8INO2M.W.:
249.04Type:
Small moleculeAlogP:
0.88Polar Surface Area:
63.32HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.68DETAILS - ALA398546
Name:
anti-1-amino-3-[[(123)I]-2-iodoethenyl]-cyclobutane-1-carboxylic acidMol. Formula:
C7H10INO2M.W.:
263.07Type:
Small moleculeAlogP:
1.13Polar Surface Area:
63.32HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.74DETAILS - ALA399286
Name:
syn-1-amino-3-[[(123)I]-2-iodoethenyl]-cyclobutane-1-carboxylic acidMol. Formula:
C7H10INO2M.W.:
263.07Type:
Small moleculeAlogP:
1.13Polar Surface Area:
63.32HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.74DETAILS - ALA413408
Name:
(R)-2-amino-2-methyl-4-[131I]iodo-3-(E)-butenoic acidMol. Formula:
C5H8INO2M.W.:
245.03Type:
Small moleculeAlogP:
0.74Polar Surface Area:
63.32HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.70DETAILS - ALA238500
Name:
(S)-2-amino-2-methyl-4-[123I]iodo-3-(E)-butenoic acidMol. Formula:
C5H8INO2M.W.:
237.03Type:
Small moleculeAlogP:
0.74Polar Surface Area:
63.32HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.70DETAILS
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