Molecular Properties | |
SMILES: | N#Cc1nc(NC(=O)CCl)cc(NC(=O)CCl)n1 |
MW: | 287.0 |
Fraction sp3: | 0.22 |
HBA: | 5 |
HBD: | 2 |
Rotatable Bonds: | 4 |
TPSA: | 107.77 |
cLogP: | 0.7 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
LON-WEI-8f408cad-3
MAK-UNK-72659d64-1
0.521
MAK-UNK-72659d64-17
0.458
MAK-UNK-72659d64-12
0.440
MAK-UNK-72659d64-3
0.438
MAK-UNK-849bee6c-25
0.434
MAK-UNK-72659d64-9
0.426
MAK-UNK-72659d64-2
0.385
MAK-UNK-72659d64-14
0.373
MAK-UNK-72659d64-18
0.370
MAK-UNK-72659d64-4
0.351
MAK-UNK-72659d64-16
0.345
MAK-UNK-6ca90168-29
0.339
MAK-UNK-72659d64-11
0.333
MAK-UNK-ca11b4f7-1
0.308
YOI-UNK-144e4c15-1
0.308
MAK-UNK-72659d64-6
0.298
MAK-UNK-72659d64-15
0.297
MAK-UNK-72659d64-7
0.296
MAK-UNK-f983951f-23
0.296
YOI-UNK-4c10088f-2
0.293
SAD-SAT-6b5a89f0-8
0.292
MAK-UNK-72659d64-5
0.288
MAR-TRE-6a44bbf2-88
0.283
AAR-RCN-748c104b-1
0.283
MAK-UNK-849bee6c-22
0.282
MAK-UNK-ed378e62-9
0.280
SAD-SAT-6b5a89f0-10
0.280
MAR-TRE-6a44bbf2-55
0.274
MAK-UNK-72659d64-8
0.274
AAR-POS-0daf6b7e-20
0.273
AAR-RCN-8752a6eb-1
0.273
AAR-POS-0daf6b7e-4
0.273
MAK-UNK-987948f6-7
0.271
YOI-UNK-144e4c15-2
0.271
RAF-SAT-b3ff87a1-4
0.271
PRO-INS-c91ddbbd-1
0.270
MAK-UNK-72659d64-13
0.270
MAK-UNK-849bee6c-26
0.270
SAD-SAT-6b5a89f0-1
0.269
MAT-POS-fa06b69f-2
0.269
TAT-ENA-80bfd3e5-7
0.269
YOI-UNK-4c10088f-1
0.268
MAK-UNK-6ca90168-26
0.268
YOI-UNK-97f54f0c-1
0.262
MAR-TRE-6c5ef77a-74
0.260
MAK-UNK-f983951f-17
0.260
SAD-SAT-6b5a89f0-4
0.259
SAD-SAT-6b5a89f0-3
0.259
MAK-UNK-f983951f-22
0.259
MAK-UNK-f983951f-13
0.255
MAR-TRE-6a44bbf2-51
0.254
MAK-UNK-ed378e62-14
0.254
MAR-TRE-6a44bbf2-40
0.254
MAK-UNK-849bee6c-3
0.250
MAR-TRE-6a44bbf2-74
0.250
DAV-CRI-3edb475e-1
0.250
MAK-UNK-849bee6c-9
0.250
MAK-UNK-849bee6c-2
0.250
MAT-POS-e10a589d-4
0.250
MAR-TRE-1c920f6f-26
0.247
AGN-NEW-c7b24fe3-4
0.243
MAR-TRE-6a44bbf2-60
0.242
MAR-TRE-6a44bbf2-17
0.242
MAR-TRE-6a44bbf2-93
0.242
MAK-UNK-ed378e62-24
0.242
MAR-TRE-a3327163-60
0.242
MAK-UNK-f983951f-15
0.241
MAK-UNK-f983951f-14
0.241
DUN-NEW-f8ce3686-23
0.241
MAR-TRE-f5c2d31c-6
0.241
MAR-TRE-6c5ef77a-47
0.241
DAV-CRI-d1e0885a-3
0.240
MAK-UNK-6ca90168-23
0.239
PET-SGC-cb62ec31-1
0.239
MAK-UNK-7a704a63-10
0.239
AAR-POS-0daf6b7e-11
0.239
LON-WEI-8f408cad-1
0.239
MAR-TRE-14ce9fd6-51
0.239
MAR-TRE-6a44bbf2-89
0.238
MAR-TRE-6a44bbf2-95
0.235
MAR-TRE-6c5ef77a-48
0.234
JOH-UNI-3fc3434e-8
0.234
JOH-UNI-ee5ed7c8-8
0.234
DAV-CRI-d1e0885a-2
0.234
AAR-POS-0daf6b7e-10
0.233
DAV-CRI-3edb475e-2
0.233
DAV-CRI-3edb475e-4
0.233
DAV-CRI-d1e0885a-6
0.233
MAR-TRE-a3327163-29
0.233
MAK-UNK-f983951f-11
0.232
IND-SYN-2c708b29-4
0.232
MAR-TRE-a3327163-11
0.232
WAL-WAB-df110a02-1
0.232
PET-UNK-6314f867-3
0.231
MAR-TRE-6c5ef77a-31
0.231
MAR-TRE-6a44bbf2-16
0.230
MAR-TRE-6a44bbf2-90
0.230
AAR-RCN-37d0aa00-1
0.229
AHN-SAT-de2502ba-10
0.229
SAD-SAT-1b030f84-2
0.228