Molecular Properties | |
SMILES: | Cc1ccccc1CN1CCN(C(=O)N2CCN(C(=O)C(C)F)CC2)CC1 |
MW: | 376.476 |
Fraction sp3: | 0.6 |
HBA: | 3 |
HBD: | 0 |
Rotatable Bonds: | 3 |
TPSA: | 47.1 |
cLogP: | 1.73482 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✔️ |
JON-UIO-066ce08b-9
0.677
MAK-UNK-7c9d1431-20
0.571
TAT-ENA-80bfd3e5-20
0.500
AAR-POS-d2a4d1df-41
0.500
JON-UIO-066ce08b-11
0.465
MAK-UNK-6ca90168-10
0.371
JOO-IND-6372a4f3-6
0.367
JON-UIO-066ce08b-15
0.356
SEL-UNI-cd366922-6
0.325
STE-UNK-13e151dd-1
0.321
JOH-UNI-0e1753c1-1
0.316
SAD-SAT-65574d3f-10
0.316
MAK-UNK-af83ef51-15
0.312
MAK-UNK-af83ef51-10
0.310
MIH-UNI-e573136b-5
0.305
MAK-UNK-e4a48a85-26
0.303
AAR-POS-d2a4d1df-24
0.303
JUL-TUD-06b2044f-30
0.302
SAD-SAT-b55127ae-7
0.302
TAM-UNI-d1c3dd9f-18
0.302
KIM-UNI-7d12df64-2
0.301
JAN-GHE-fd8d85a5-2
0.300
JOO-IND-6372a4f3-5
0.298
DAR-DIA-fb20be43-2
0.298
AAR-POS-d2a4d1df-40
0.296
JAN-GHE-fd8d85a5-10
0.296
MED-COV-4280ac29-31
0.296
JAN-GHE-fd8d85a5-8
0.294
MAK-UNK-10dfa458-7
0.292
JUL-TUD-06b2044f-126
0.292
KIM-UNI-7d12df64-3
0.291
JON-UIO-066ce08b-10
0.287
ALP-POS-3fc1724e-3
0.287
DAR-DIA-fb20be43-3
0.284
DAR-DIA-fb20be43-7
0.284
MAK-UNK-212f693e-7
0.284
BEN-VAN-c986b20b-13
0.283
NEH-REV-107bcf72-5
0.282
JOO-IND-6372a4f3-4
0.280
KIM-UNI-7d12df64-1
0.280
BEN-VAN-c986b20b-9
0.280
DAR-DIA-fb20be43-8
0.279
PAU-UNI-19862c28-1
0.279
JAN-GHE-fd8d85a5-9
0.279
MED-COV-4280ac29-37
0.279
MAK-UNK-7c9d1431-24
0.278
DRR-IMP-38dce17f-3
0.278
MAK-UNK-6435e6c2-3
0.278
TAM-UNI-d1c3dd9f-20
0.277
JON-UIO-066ce08b-1
0.276
BEN-VAN-d8fd1356-22
0.276
JUL-TUD-06b2044f-29
0.276
PAT-UNK-b2d83456-2
0.275
MAK-UNK-902cc841-2
0.275
PAT-UNK-b2d83456-4
0.275
MAK-UNK-6435e6c2-2
0.274
BEN-VAN-c986b20b-2
0.273
BEN-VAN-c986b20b-17
0.273
TAM-UNI-d1c3dd9f-17
0.273
DUN-NEW-f8ce3686-2
0.272
TAM-UNI-d1c3dd9f-9
0.272
JUL-TUD-06b2044f-57
0.271
DUN-NEW-f8ce3686-24
0.271
BEN-VAN-d8fd1356-21
0.271
MAK-UNK-6ca90168-4
0.269
RAM-SYN-2a37ce6c-1
0.268
DRR-IMP-38dce17f-8
0.267
BEN-VAN-d8fd1356-23
0.267
VIT-UNK-cff011c0-2
0.267
DAR-DIA-fb20be43-6
0.267
MIH-UNI-e573136b-4
0.267
MAR-TRE-c8530538-9
0.266
SAD-SAT-5b1897b2-2
0.266
DRR-IMP-38dce17f-2
0.266
PAT-UNK-b2d83456-1
0.266
BEN-VAN-d8fd1356-24
0.264
TAM-UNI-d1c3dd9f-13
0.264
BOG-INS-bdba9cfb-1
0.262
MAT-POS-4e253971-2
0.261
BEN-VAN-d8fd1356-20
0.261
MED-COV-4280ac29-19
0.261
DAR-DIA-fb20be43-9
0.261
TAM-UNI-d1c3dd9f-14
0.261
DRR-IMP-38dce17f-5
0.260
SAD-SAT-bc31ec01-1
0.260
JON-UNI-bb9dc649-11
0.259
MAK-UNK-7c9d1431-21
0.259
JON-UIO-066ce08b-4
0.259
MAR-TRE-6a44bbf2-27
0.259
MAK-UNK-6ca90168-7
0.259
JAN-GHE-1d98ec1c-8
0.259
JAN-GHE-fd8d85a5-1
0.259
GIA-UNK-7337c2f3-9
0.259
BEN-VAN-c986b20b-3
0.258
BEN-VAN-c986b20b-16
0.258
DAR-DIA-fb20be43-1
0.258
STU-CHA-464c0256-1
0.258
TAM-UNI-d1c3dd9f-15
0.258
JAN-GHE-6413aaf8-5
0.258
STU-CHA-bc0a9883-1
0.258