PropybicyphatName:
4-Propyl-2,6,7-trioxa-1-phospha-bic yclo[2.2.2]octane1-oxideMol. Formula:
C7H13O4PM.W.:
192.15Type:
Small moleculeAlogP:
1.96Polar Surface Area:
44.76HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.63DETAILS
ALA2287386Name:
3-Methyl-4-propyl-2,6,7-trioxa-1-phospha-bicyclo[2.2.2]octane1-sulfideMol. Formula:
C8H15O3PSM.W.:
222.25Type:
Small moleculeAlogP:
2.46Polar Surface Area:
27.69HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.67DETAILS
ALA2287384Name:
3-Ethyl-4-propyl-2,6,7-trioxa-1-phospha-bicyclo[2.2.2]octane1-sulfideMol. Formula:
C9H17O3PSM.W.:
236.27Type:
Small moleculeAlogP:
2.85Polar Surface Area:
27.69HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.70DETAILS
ALA2287383Name:
3,4-Dipropyl-2,6,7-trioxa-1-phospha-bicyclo[2.2.2]octane1-sulfideMol. Formula:
C10H19O3PSM.W.:
250.30Type:
Small moleculeAlogP:
3.24Polar Surface Area:
27.69HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.72DETAILS
ALA2287382Name:
3-Butyl-4-propyl-2,6,7-trioxa-1-phospha-bicyclo[2.2.2]octane1-sulfideMol. Formula:
C11H21O3PSM.W.:
264.33Type:
Small moleculeAlogP:
3.63Polar Surface Area:
27.69HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.71DETAILS- ALA2287381
Name:
3-Isopropyl-4-propyl-2,6,7-trioxa-1-phospha-bicyclo[2.2.2]octane1-sul fideMol. Formula:
C10H19O3PSM.W.:
250.30Type:
Small moleculeAlogP:
3.10Polar Surface Area:
27.69HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
3Passes Ro3:
NQED Weighted:
0.72DETAILS - ALA2287380
Name:
3-sec-Butyl-4-propyl-2,6,7-trioxa-1-phospha-bicyclo[2.2.2]octane1-sul fideMol. Formula:
C11H21O3PSM.W.:
264.33Type:
Small moleculeAlogP:
3.49Polar Surface Area:
27.69HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.73DETAILS - ALA2287379
Name:
3-Isobutyl-4-propyl-2,6,7-trioxa-1-phospha-bicyclo[2.2.2]octane1-sulf ideMol. Formula:
C11H21O3PSM.W.:
264.33Type:
Small moleculeAlogP:
3.49Polar Surface Area:
27.69HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
4Passes Ro3:
NQED Weighted:
0.73DETAILS - ALA2287378
Name:
3-tert-Butyl-4-propyl-2,6,7-trioxa-1-phospha-bicyclo[2.2.2]octane1-su lfideMol. Formula:
C11H21O3PSM.W.:
264.33Type:
Small moleculeAlogP:
3.49Polar Surface Area:
27.69HBA:
4HBD:
---#RO5 Violations:
---#Rotatable Bonds:
2Passes Ro3:
NQED Weighted:
0.71DETAILS -
Type:
Small moleculeAlogP:
1.91Polar Surface Area:
56.79HBA:
4HBD:
1#RO5 Violations:
---#Rotatable Bonds:
1Passes Ro3:
NQED Weighted:
0.79DETAILS -
Type:
Small moleculeAlogP:
6.38Polar Surface Area:
48.78HBA:
2HBD:
2#RO5 Violations:
1#Rotatable Bonds:
5Passes Ro3:
NQED Weighted:
0.29DETAILS
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