ALA3596408Name:
5-bromo-4-chloro-7-cyclopentyl-7H-pyrrolo[2,3-d]pyrimidineMol. Formula:
C11H11BrClN3M.W.:
300.59Type:
Small moleculeAlogP:
3.96Polar Surface Area:
30.71HBA:
3HBD:
---#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.75DETAILS
2-Amino-4-(3-methoxyphenyl)thiazoleName:
4-(3-methoxyphenyl)thiazol-2-amineMol. Formula:
C10H10N2OSM.W.:
206.27Type:
Small moleculeAlogP:
2.40Polar Surface Area:
48.14HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.82DETAILS
Type:
Small moleculeAlogP:
3.41Polar Surface Area:
38.91HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.83DETAILS
4-(3-(Trifluoromethyl)phenyl)thiazol-2-amineName:
4-(3-(trifluoromethyl)phenyl)thiazol-2-amineMol. Formula:
C10H7F3N2SM.W.:
244.24Type:
Small moleculeAlogP:
3.41Polar Surface Area:
38.91HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.83DETAILS
4-(4-(Trifluoromethyl)phenyl)thiazol-2-amineName:
4-(4-(trifluoromethyl)phenyl)thiazol-2-amineMol. Formula:
C10H7F3N2SM.W.:
244.24Type:
Small moleculeAlogP:
3.41Polar Surface Area:
38.91HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.83DETAILS-
Type:
Small moleculeAlogP:
2.70Polar Surface Area:
38.91HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
YQED Weighted:
0.75DETAILS -
Type:
Small moleculeAlogP:
2.10Polar Surface Area:
59.14HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.73DETAILS -
Type:
Small moleculeAlogP:
2.10Polar Surface Area:
59.14HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.73DETAILS -
Type:
Small moleculeAlogP:
1.97Polar Surface Area:
64.93HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.68DETAILS - 4-(4-Amino-Phenyl)-Thiazol-2-Ylamine
Name:
4-(4-aminophenyl)thiazol-2-amineMol. Formula:
C9H9N3SM.W.:
191.26Type:
Small moleculeAlogP:
1.97Polar Surface Area:
64.93HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.68DETAILS - 5-methyl-4,5,6,7-tetrahydro[1,3]thiazolo[5,4-c]pyridin-2-amine
Name:
5-methyl-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridin-2-amineMol. Formula:
C7H11N3SM.W.:
169.25Type:
Small moleculeAlogP:
0.71Polar Surface Area:
42.15HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.62DETAILS -
Type:
ProteinAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
Small moleculeAlogP:
2.28Polar Surface Area:
64.93HBA:
4HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.70DETAILS -
Type:
Small moleculeAlogP:
2.14Polar Surface Area:
57.94HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
YQED Weighted:
0.72DETAILS -
Type:
ProteinAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
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