ALA491290Name:
2,7-dihydroxy-9H-fluoren-9-oneCas Number:
42523-29-5Mol. Formula:
C13H8O3M.W.:
212.20Type:
Small moleculeAlogP:
2.31Polar Surface Area:
57.53HBA:
3HBD:
2#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
YQED Weighted:
0.60DETAILS
Type:
Small moleculeAlogP:
3.26Polar Surface Area:
44.48HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.90DETAILS
ALA491289Name:
3-(furan-2-yl)-3-(2-methoxyphenyl)propan-1-amineCas Number:
378778-71-3Mol. Formula:
C14H17NO2M.W.:
231.29Type:
Small moleculeAlogP:
2.77Polar Surface Area:
48.39HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.86DETAILS
ALA455684Name:
2-amino-1-(10H-phenothiazin-10-yl)ethanoneCas Number:
727-50-4Mol. Formula:
C14H12N2OSM.W.:
256.33Type:
Small moleculeAlogP:
2.77Polar Surface Area:
46.33HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
YQED Weighted:
0.85DETAILS
Type:
Small moleculeAlogP:
2.77Polar Surface Area:
51.22HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
YQED Weighted:
0.94DETAILS-
Type:
Small moleculeAlogP:
3.00Polar Surface Area:
54.37HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
---Passes Ro3:
YQED Weighted:
0.80DETAILS -
Type:
Small moleculeAlogP:
2.74Polar Surface Area:
113.94HBA:
7HBD:
2#RO5 Violations:
---#Rotatable Bonds:
6Passes Ro3:
NQED Weighted:
0.49DETAILS -
Type:
Small moleculeAlogP:
3.21Polar Surface Area:
41.99HBA:
2HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.89DETAILS
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