Streptococcus agalactiae
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ID: ALA614622
Type: ORGANISM
Organism: Streptococcus agalactiae
Species Group: Streptococcus agalactiae
Name:
4,11-Bis(4-fluorophenyl)-1,8-bis(4-methylphenyl)-3,10-diphenyl-1,2,8,9-tetraazadispiro[4.1.4.2]trideca-2,9-dien-6-one
Mol. Formula:
C47H38F2N4O
M.W.:
712.84
Type:
Small molecule
AlogP:
10.14
Polar Surface Area:
48.27
HBA:
5
HBD:
0
#RO5 Violations:
2
#Rotatable Bonds:
6
Passes Ro3:
N
QED Weighted:
0.17
Name:
3-[(3S,6S,9S,12S,15S,21S,24S,27S,30S,33S)-3,21-dibenzyl-27-(2-carbamoylethyl)-2,5,8,11,14,20,23,26,29,32-decaoxo-6,12,24,30-tetrakis(propan-2-yl)-1,4,7,10,13,19,22,25,28,31-decaazatricyclo[31.3.0.0^{15,19}]hexatriacontan-9-yl]propanamide
Mol. Formula:
C58H84N12O12
M.W.:
1141.38
Type:
Protein
Name:
3-[(3S,6S,9S,12S,15S,21S,24S,27S,30S,33S)-3,21-dibenzyl-27-(2-carbamoylethyl)-24-(2-methylpropyl)-2,5,8,11,14,20,23,26,29,32-decaoxo-6,12,30-tris(propan-2-yl)-1,4,7,10,13,19,22,25,28,31-decaazatricyclo[31.3.0.0^{15,19}]hexatriacontan-9-yl]propanamide
Mol. Formula:
C59H86N12O12
M.W.:
1155.41
Type:
Protein
Name:
3-[(3S,6S,9S,12S,15S,21S,24S,27S,30S,33S)-3,21-dibenzyl-27-(2-carbamoylethyl)-30-(2-methylpropyl)-2,5,8,11,14,20,23,26,29,32-decaoxo-6,12,24-tris(propan-2-yl)-1,4,7,10,13,19,22,25,28,31-decaazatricyclo[31.3.0.0^{15,19}]hexatriacontan-9-yl]propanamide
Mol. Formula:
C59H86N12O12
M.W.:
1155.41
Type:
Protein
Name:
3-[(3S,6S,9S,12S,15S,21S,24S,27S,30S,33S)-3,21-dibenzyl-27-(2-carbamoylethyl)-6,12,24,30-tetrakis(2-methylpropyl)-2,5,8,11,14,20,23,26,29,32-decaoxo-1,4,7,10,13,19,22,25,28,31-decaazatricyclo[31.3.0.0^{15,19}]hexatriacontan-9-yl]propanamide
Mol. Formula:
C62H92N12O12
M.W.:
1197.49
Type:
Protein
Name:
3-[(3S,6S,9S,12S,15S,21S,24S,27S,30S,33S)-3,21-dibenzyl-27-(2-carbamoylethyl)-12,24,30-tris(2-methylpropyl)-2,5,8,11,14,20,23,26,29,32-decaoxo-6-(propan-2-yl)-1,4,7,10,13,19,22,25,28,31-decaazatricyclo[31.3.0.0^{15,19}]hexatriacontan-9-yl]propanamide
Mol. Formula:
C61H90N12O12
M.W.:
1183.46
Type:
Protein
Name:
3-[(3S,6S,9S,12S,15S,21S,24S,27S,30S,33S)-3,21-dibenzyl-27-(2-carbamoylethyl)-6,24-bis(2-methylpropyl)-2,5,8,11,14,20,23,26,29,32-decaoxo-12,30-bis(propan-2-yl)-1,4,7,10,13,19,22,25,28,31-decaazatricyclo[31.3.0.0^{15,19}]hexatriacontan-9-yl]propanamide
Mol. Formula:
C60H88N12O12
M.W.:
1169.44
Type:
Protein
Name:
3-[(3S,6S,9S,12S,15S,21S,24S,27S,30S,33S)-3,21-dibenzyl-27-(2-carbamoylethyl)-12,24-bis(2-methylpropyl)-2,5,8,11,14,20,23,26,29,32-decaoxo-6,30-bis(propan-2-yl)-1,4,7,10,13,19,22,25,28,31-decaazatricyclo[31.3.0.0^{15,19}]hexatriacontan-9-yl]propanamide
Mol. Formula:
C60H88N12O12
M.W.:
1169.44
Type:
Protein
Name:
3-[(3S,6S,9S,12S,15S,21S,24S,27S,30S,33S)-3,21-dibenzyl-27-(2-carbamoylethyl)-24,30-bis(2-methylpropyl)-2,5,8,11,14,20,23,26,29,32-decaoxo-6,12-bis(propan-2-yl)-1,4,7,10,13,19,22,25,28,31-decaazatricyclo[31.3.0.0^{15,19}]hexatriacontan-9-yl]propanamide
Mol. Formula:
C60H88N12O12
M.W.:
1169.44
Type:
Protein
Name:
3-[(3R,6S,9S,12S,15S,21R,24S,27S,30S,33S)-27-(2-carbamoylethyl)-3,21-bis[(4-hydroxyphenyl)methyl]-6,24-bis(2-methylpropyl)-2,5,8,11,14,20,23,26,29,32-decaoxo-12,30-bis(propan-2-yl)-1,4,7,10,13,19,22,25,28,31-decaazatricyclo[31.3.0.0^{15,19}]hexatriacontan-9-yl]propanamide
Mol. Formula:
C60H88N12O14
M.W.:
1201.43
Type:
Protein