Molecule Details
| Molecular Properties | |
| SMILES: | CCCCC1C(CCCC)C(CCCC)C(CCCC)C(CCCC)C(CCCC)C1CCCC |
| MW: | 490.55 |
| Fraction sp3: | 1.0 |
| HBA: | 0 |
| HBD: | 0 |
| Rotatable Bonds: | 21 |
| TPSA: | 0.0 |
| cLogP: | 12.64 |
| Covalent Warhead: | ✗ |
| Covalent Fragment: | ✗ |
THE-UNK-833274f3-1
1.000
THE-UNK-833274f3-2
1.000
THE-UNK-833274f3-5
1.000
THE-UNK-833274f3-4
1.000
THE-UNK-833274f3-3
1.000
THE-UNK-833274f3-7
0.789
THE-UNK-833274f3-8
0.789
MAK-UNK-0cb6a3ad-2
0.200
JAM-UNK-fcc74568-1
0.167
JOH-IMS-54aa76a2-2
0.140
MAR-TRE-8a25d817-58
0.137
AAR-POS-d2a4d1df-17
0.136
MAR-TRE-87acfbcc-21
0.132
GIA-UNK-4c151a93-1
0.130
MAR-TRE-8a25d817-61
0.130
MAK-UNK-5e88aa6a-11
0.128
MAK-UNK-5e88aa6a-2
0.128
LUK-UNK-02ef1050-1
0.127
MAR-TRE-87acfbcc-22
0.125
MAR-TRE-36bf7dba-67
0.123
MAK-UNK-4b073b5c-13
0.121
MAR-TRE-87acfbcc-13
0.120
MAR-TRE-87acfbcc-40
0.119
MAR-TRE-ebcc4ad6-32
0.118
MAR-TRE-d3c2bf0e-26
0.116
MAR-TRE-87acfbcc-84
0.116
MAR-TRE-8a25d817-11
0.115
MAR-TRE-4f39ef4a-29
0.113
LOR-NOR-c954e7ad-2
0.111
MAR-TRE-aca67d11-54
0.111
DAR-DIA-eace69ff-34
0.111
TAT-ENA-80bfd3e5-38
0.110
ALE-UNK-fca05062-7
0.109
MAK-UNK-72659d64-14
0.109
JAN-GHE-f4ca5a00-19
0.108
MAK-UNK-c7aa8293-6
0.107
MAR-TRE-14ce9fd6-86
0.107
CAM-STU-3ef21e73-1
0.105
MAR-TRE-dab8f6ea-27
0.105
MAK-UNK-01147c51-14
0.104
MAT-POS-ea426761-32
0.103
ANT-OPE-5f377dcc-1
0.103
SUN-DEP-1496052a-1
0.103
MAR-TRE-d0525fbf-87
0.103
MAR-TRE-14ce9fd6-80
0.102
MAR-TRE-a3327163-10
0.102
MAR-TRE-74c6519b-50
0.101
ANT-OPE-3ffdc102-1
0.100
MAR-TRE-aca67d11-44
0.100
MAR-TRE-14ce9fd6-81
0.100
MAR-TRE-8a25d817-37
0.100
MAR-TRE-8a25d817-32
0.100
EDG-MED-0da5ad92-7
0.099
MAT-POS-ea426761-73
0.099
SAD-SAT-29425be4-12
0.099
MAR-TRE-dab8f6ea-44
0.099
JAN-GHE-fd8d85a5-7
0.098
MAR-TRE-a78003aa-13
0.098
MAR-TRE-36bf7dba-95
0.098
MAR-TRE-8a25d817-87
0.098
MAR-TRE-85681e92-35
0.098
MAR-TRE-dab8f6ea-8
0.098
JAN-GHE-f4ca5a00-11
0.097
MAR-TRE-7f7bb9f0-60
0.097
MAT-POS-ea426761-49
0.097
ABI-SAT-2adc218e-8
0.097
MAT-POS-b5746674-102
0.096
LON-WEI-5e7d1b3e-38
0.096
MAT-POS-2492181e-10
0.096
LON-WEI-4d77710c-38
0.096
MAR-TRE-87acfbcc-20
0.096
YOI-UNK-15f562e8-5
0.096
DAR-DIA-eace69ff-25
0.095
DAR-DIA-eace69ff-28
0.095
MAK-UNK-c749d764-14
0.095
MAT-POS-162a9720-14
0.095
JAG-UCB-ef2c0e8e-6
0.095
MAR-TRE-a3327163-19
0.094
MAR-TRE-6a44bbf2-97
0.094
ABI-SAT-128a7dc3-5
0.094
JOH-IMS-0780e8d1-1
0.094
ABI-SAT-f7794817-4
0.094
MAT-POS-ea426761-51
0.094
JOH-IMS-0780e8d1-6
0.094
JAN-GHE-f4ca5a00-20
0.093
MAR-TRE-14ce9fd6-98
0.093
MAK-UNK-2c1752f0-5
0.093
MAR-TRE-d3c2bf0e-22
0.093
MAR-TRE-6c5ef77a-42
0.093
MAR-TRE-8a25d817-62
0.093
JAN-GHE-f4ca5a00-18
0.092
MAT-POS-b5746674-95
0.092
JAN-GHE-f4ca5a00-15
0.092
DAR-DIA-eace69ff-24
0.091
JOH-IMS-0780e8d1-5
0.091
JOH-UNI-c7afdb96-10
0.091
MAR-TRE-423310b6-88
0.091
JOH-IMS-0780e8d1-3
0.091
MAK-UNK-212f693e-19
0.091
GIA-UNK-995df016-6
0.091