Type:
---AlogP:
3.52Polar Surface Area:
119.00HBA:
7HBD:
2#RO5 Violations:
1#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.43DETAILS
Type:
---AlogP:
2.32Polar Surface Area:
133.27HBA:
9HBD:
1#RO5 Violations:
1#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.25DETAILS
Type:
---AlogP:
2.86Polar Surface Area:
130.00HBA:
7HBD:
3#RO5 Violations:
1#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.38DETAILS
Type:
---AlogP:
5.01Polar Surface Area:
77.02HBA:
5HBD:
2#RO5 Violations:
2#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.50DETAILS
Type:
---AlogP:
2.75Polar Surface Area:
116.20HBA:
8HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.27DETAILS-
Type:
---AlogP:
2.90Polar Surface Area:
126.85HBA:
8HBD:
3#RO5 Violations:
1#Rotatable Bonds:
---Passes Ro3:
NQED Weighted:
0.25DETAILS -
Type:
---AlogP:
2.75Polar Surface Area:
116.20HBA:
8HBD:
1#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.36DETAILS -
Type:
---AlogP:
5.71Polar Surface Area:
78.79HBA:
4HBD:
3#RO5 Violations:
2#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.43DETAILS -
Type:
---AlogP:
3.56Polar Surface Area:
115.85HBA:
8HBD:
2#RO5 Violations:
1#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.29DETAILS -
Type:
UnknownAlogP:
3.24Polar Surface Area:
180.87HBA:
10HBD:
2#RO5 Violations:
1#Rotatable Bonds:
8Passes Ro3:
NQED Weighted:
0.19DETAILS -
Type:
ProteinAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
ProteinAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
ProteinAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS -
Type:
Small moleculeAlogP:
6.02Polar Surface Area:
68.96HBA:
2HBD:
3#RO5 Violations:
1#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.34DETAILS - ALA2172436
Name:
2-(2-((1H-pyrrol-2-yl)methylene)-3-methoxy-2H-pyrrol-5-yl)-1H-indoleMol. Formula:
C18H15N3OM.W.:
289.34Type:
Small moleculeAlogP:
3.87Polar Surface Area:
53.17HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.76DETAILS -
Type:
Small moleculeAlogP:
4.63Polar Surface Area:
53.17HBA:
2HBD:
2#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.70DETAILS - ALA2172432
Name:
2-((5-(furan-2-yl)-3-methoxy-2H-pyrrol-2-ylidene)methyl)-1H-pyrroleMol. Formula:
C14H12N2O2M.W.:
240.26Type:
Small moleculeAlogP:
2.98Polar Surface Area:
50.52HBA:
3HBD:
1#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
YQED Weighted:
0.90DETAILS -
Type:
Small moleculeAlogP:
-0.33Polar Surface Area:
178.71HBA:
7HBD:
3#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.59DETAILS - ALA1800272
Name:
4-(N-acetyl-N-(6,7,8,9-tetrahydrodibenzo[b,d]furan-2-yl)sulfamoyl)benzoateMol. Formula:
C21H19NO6SM.W.:
413.45Type:
Small moleculeAlogP:
3.75Polar Surface Area:
104.89HBA:
5HBD:
1#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.70DETAILS - ALA386769
Name:
H-Glu-Gly-Leu-Asn-pTyr-Ser(betaPh)-Val-leu-NH2Mol. Formula:
C46H68N9O17PM.W.:
1050.07Type:
Small moleculeAlogP:
---Polar Surface Area:
---HBA:
---HBD:
---#RO5 Violations:
na#Rotatable Bonds:
---Passes Ro3:
---QED Weighted:
---DETAILS
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