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SCFBio, IIT Delhi Hauz Khas, New Delhi

Chemical Library

Physicochemical properties (MW, LogP) of all entries.

Total Rows 105,909
Pages 4,237
BIMP_ID Name Mol Weight LogP HBD HBA TPSA Rotatable Bonds
9-cis-Lutein
568.90
11
2
2
40.46
10
9a(2)-cis-Lutein
568.90
11
2
2
40.46
10
1-Hydroxy-3-methoxy-7-primeverosyloxyxanthone
552.50
-1.1
7
14
217.97
6
Neocuscutoside C
694.60
-1.6
7
17
233.91
8
1,1-Dihydroxypropan-2-one
90.08
-1.3
2
3
57.53
1
4-Penten-1-OL
86.13
1
1
1
20.23
3
[(2R)-1-hexadecanoyloxy-3-octadecanoyloxypropan-2-yl] icosanoate
891.50
25.2
0
6
78.9
56
[(2R)-1-hexadecanoyloxy-3-octadecanoyloxypropan-2-yl] docosanoate
919.50
26.3
0
6
78.9
58
(2S)-2-amino-3-[[(2R)-2,3-bis[[(Z)-octadec-11-enoyl]oxy]propoxy]-hydroxyphosphoryl]oxypropanoic acid
788.00
10.2
3
11
181.49
42
(2S)-2-amino-3-[hydroxy-[(2R)-3-octadecanoyloxy-2-[(Z)-octadec-11-enoyl]oxypropoxy]phosphoryl]oxypropanoic acid
790.10
11.1
3
11
181.49
43
(2S)-2-amino-3-[hydroxy-[(2R)-3-[(Z)-octadec-9-enoyl]oxy-2-[(Z)-octadec-11-enoyl]oxypropoxy]phosphoryl]oxypropanoic acid
788.00
10.2
3
11
181.49
42
(2S)-2-amino-3-[[(2R)-2-[(Z)-docos-13-enoyl]oxy-3-hexadecanoyloxypropoxy]-hydroxyphosphoryl]oxypropanoic acid
818.10
12.2
3
11
181.49
45
(2S)-2-amino-3-[[(2R)-2-[(Z)-docos-13-enoyl]oxy-3-octadecanoyloxypropoxy]-hydroxyphosphoryl]oxypropanoic acid
846.20
13.3
3
11
181.49
47
PS(18:1(11Z)/18:2(9Z,12Z))
786.00
9.5
3
11
181.49
41
PS(18:1(11Z)/18:3(6Z,9Z,12Z))
784.00
8.8
3
11
181.49
40
PS(18:1(11Z)/18:3(9Z,12Z,15Z))
784.00
8.8
3
11
181.49
40
2-Amino-3-({hydroxy[2-(icosanoyloxy)-3-[octadec-11-enoyloxy]propoxy]phosphoryl}oxy)propanoic acid
818.10
12.2
3
11
181.49
45
(2S)-2-amino-3-[hydroxy-[(2R)-2-[(Z)-icos-11-enoyl]oxy-3-[(Z)-octadec-11-enoyl]oxypropoxy]phosphoryl]oxypropanoic acid
816.10
11.3
3
11
181.49
44
(2S)-2-amino-3-[[(2R)-2-docosanoyloxy-3-[(Z)-octadec-11-enoyl]oxypropoxy]-hydroxyphosphoryl]oxypropanoic acid
846.20
13.3
3
11
181.49
47
(2S)-2-amino-3-[[(2R)-2-[(Z)-docos-13-enoyl]oxy-3-[(Z)-octadec-11-enoyl]oxypropoxy]-hydroxyphosphoryl]oxypropanoic acid
844.10
12.4
3
11
181.49
46
(2S)-2-amino-3-[[(2R)-2-[(Z)-docos-13-enoyl]oxy-3-[(Z)-octadec-9-enoyl]oxypropoxy]-hydroxyphosphoryl]oxypropanoic acid
844.10
12.4
3
11
181.49
46
PS(18:2(9Z,12Z)/22:1(13Z))
842.10
11.7
3
11
181.49
45
PS(18:3(6Z,9Z,12Z)/22:1(13Z))
840.10
11
3
11
181.49
44
PS(18:3(9Z,12Z,15Z)/22:1(13Z))
840.10
11
3
11
181.49
44
(2S)-2-amino-3-[[(2R)-2-[(Z)-docos-13-enoyl]oxy-3-icosanoyloxypropoxy]-hydroxyphosphoryl]oxypropanoic acid
874.20
14.4
3
11
181.49
49
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