Type:
Small moleculeAlogP:
1.39Polar Surface Area:
32.34HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
YQED Weighted:
0.75DETAILS
Type:
Small moleculeAlogP:
1.39Polar Surface Area:
32.34HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
YQED Weighted:
0.75DETAILS
Type:
Small moleculeAlogP:
1.78Polar Surface Area:
32.34HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
YQED Weighted:
0.78DETAILS
Type:
Small moleculeAlogP:
1.78Polar Surface Area:
32.34HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
YQED Weighted:
0.78DETAILS
Type:
Small moleculeAlogP:
1.53Polar Surface Area:
32.34HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
YQED Weighted:
0.75DETAILS-
Type:
Small moleculeAlogP:
1.53Polar Surface Area:
32.34HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
YQED Weighted:
0.75DETAILS - ALA2180838
Name:
N-[5-(4-Methoxy-phenyl)-2H-pyrazol-3-yl]-4-[1,4]oxazepan-4-yl-butyramideMol. Formula:
C19H26N4O3M.W.:
358.44Type:
Small moleculeAlogP:
2.53Polar Surface Area:
79.48HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.80DETAILS - ALA2180837
Name:
N-[5-(4-Methoxy-phenyl)-2H-pyrazol-3-yl]-4-morpholin-4-yl-butyramideMol. Formula:
C18H24N4O3M.W.:
344.42Type:
Small moleculeAlogP:
2.14Polar Surface Area:
79.48HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.80DETAILS - ALA2165453
Name:
3-(Phenoxymethyl)-5-[(2(S)-pyrrolidinyl)methoxy]isoxazoleMol. Formula:
C15H18N2O3M.W.:
274.32Type:
Small moleculeAlogP:
2.38Polar Surface Area:
56.52HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.88DETAILS - ALA2165452
Name:
5-[(2(S)-Azetidinyl)methoxy]-3-(phenoxymethyl)isoxazoleMol. Formula:
C14H16N2O3M.W.:
260.29Type:
Small moleculeAlogP:
1.99Polar Surface Area:
56.52HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.86DETAILS - ALA2165451
Name:
5-[(2(S)-Azetidinyl)methoxy]-3-isoxazolylmethanolMol. Formula:
C8H12N2O3M.W.:
184.19Type:
Small moleculeAlogP:
-0.09Polar Surface Area:
67.52HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.68DETAILS -
Type:
Small moleculeAlogP:
0.72Polar Surface Area:
47.29HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.72DETAILS - ALA2165449
Name:
3-[(2(S)-Azetidinyl)methoxy]-5-[(cyclopropylmethoxy)-methyl]isoxazoleMol. Formula:
C12H18N2O3M.W.:
238.29Type:
Small moleculeAlogP:
1.34Polar Surface Area:
56.52HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
7Passes Ro3:
NQED Weighted:
0.78DETAILS - ALA2165447
Name:
3-[(2(S)-Azetidinyl)methoxy]-5-(phenoxymethyl)isoxazoleMol. Formula:
C14H16N2O3M.W.:
260.29Type:
Small moleculeAlogP:
1.99Polar Surface Area:
56.52HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.86DETAILS - ALA2165446
Name:
3-[(2(S)-Azetidinyl)methoxy]-5-isoxazolylmethanolMol. Formula:
C8H12N2O3M.W.:
184.19Type:
Small moleculeAlogP:
-0.09Polar Surface Area:
67.52HBA:
5HBD:
2#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.68DETAILS - ALA2165445
Name:
3-Methyl-5-[(2(S)-pyrrolidinyl)methoxy]isoxazoleMol. Formula:
C9H14N2O2M.W.:
182.22Type:
Small moleculeAlogP:
1.11Polar Surface Area:
47.29HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.76DETAILS - ALA2165443
Name:
5-[(2(S)-Azetidinyl)methoxy]-3-(fluoromethyl)isoxazoleMol. Formula:
C8H11FN2O2M.W.:
186.19Type:
Small moleculeAlogP:
0.88Polar Surface Area:
47.29HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.76DETAILS - ALA2165442
Name:
5-[(2(S)-Azetidinyl)methoxy]-3-[(N-cyclopentylcarbamoyloxy)methyl]isoxazoleMol. Formula:
C14H21N3O4M.W.:
295.34Type:
Small moleculeAlogP:
1.58Polar Surface Area:
85.62HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.83DETAILS - ALA2165441
Name:
5-[(2(S)-Azetidinyl)methoxy]-3-[(N-ethylcarbamoyloxy)-methyl]isoxazoleMol. Formula:
C11H17N3O4M.W.:
255.27Type:
Small moleculeAlogP:
0.66Polar Surface Area:
85.62HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.78DETAILS - ALA2165440
Name:
5-[(2(S)-Azetidinyl)methoxy]-3-[(N-phenylcarbamoyloxy)-methyl]isoxazoleMol. Formula:
C15H17N3O4M.W.:
303.32Type:
Small moleculeAlogP:
2.16Polar Surface Area:
85.62HBA:
6HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.85DETAILS
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