Molecular Properties | |
SMILES: | O=C(c1ccccc1)N(CC1CCCCC1)S(=O)(=O)c1ccccc1F |
MW: | 375.465 |
Fraction sp3: | 0.35 |
HBA: | 3 |
HBD: | 0 |
Rotatable Bonds: | 5 |
TPSA: | 54.45 |
cLogP: | 4.2371 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✔️ |
Activated haloaromatics
Hetero_hetero
WAR-XCH-bdd24732-36
0.589
WAR-XCH-bdd24732-40
0.461
WAR-XCH-bdd24732-38
0.419
WAR-XCH-bdd24732-39
0.333
WAR-XCH-bdd24732-8
0.317
WAR-XCH-72a8c209-7
0.291
MAR-TRE-6a44bbf2-11
0.287
ZAC-WAB-b0242612-1
0.286
SID-ELM-8b394441-2
0.277
SAN-PRS-52b81272-1
0.275
MIC-SGC-657978c3-8
0.274
MIC-SGC-657978c3-2
0.273
MAK-UNK-194150d3-11
0.271
DRR-IMP-dff87f5e-5
0.268
AAR-POS-d2a4d1df-34
0.268
MAR-TRE-6a44bbf2-8
0.268
MIC-SGC-657978c3-6
0.264
BEN-DND-76ad4ac9-11
0.264
BEN-DND-03406596-9
0.264
MIC-SGC-657978c3-4
0.264
MAK-UNK-b2c98f02-3
0.263
MAK-UNK-3f402c2b-11
0.261
NIM-UNI-310206f0-38
0.260
SAD-SAT-9a6c5cf3-10
0.255
SID-ELM-b654bfa2-10
0.255
ASH-UNK-40b46b30-13
0.250
WAR-XCH-bdd24732-13
0.250
WAR-XCH-bdd24732-44
0.250
DAR-DIA-eace69ff-6
0.248
MAK-UNK-b2c98f02-1
0.248
GIA-UNK-d2defdc3-2
0.247
WAR-XCH-72a8c209-4
0.244
GIA-UNK-d2defdc3-9
0.244
MAK-UNK-b2c98f02-2
0.243
MAK-UNK-b2c98f02-4
0.243
SID-ELM-2583a2cd-15
0.241
AAR-POS-d2a4d1df-13
0.241
FRA-FAC-9ed5a63a-1
0.241
ALE-HEI-f28a35b5-9
0.241
GIA-UNK-995df016-10
0.241
ZAC-WAB-0847d168-1
0.238
MAD-UNK-3bd48932-1
0.238
MAD-UNK-d7ec037c-3
0.238
MAD-UNK-d7ec037c-1
0.238
MAD-UNK-1cc096ab-1
0.238
MAD-UNK-4169353f-1
0.238
DAR-DIA-eace69ff-11
0.236
MAK-UNK-b2c98f02-5
0.235
MAR-LAB-efb042c5-2
0.235
SID-ELM-b654bfa2-9
0.233
DAR-DIA-eace69ff-10
0.233
SID-ELM-8b394441-4
0.233
NIM-UNI-bb9030bf-10
0.232
MAR-LAB-ff9967db-5
0.230
WIL-UNI-1faa9b10-27
0.230
GIA-UNK-995df016-14
0.230
SID-ELM-8b394441-20
0.229
WIL-UNI-1faa9b10-19
0.228
WIL-NOV-066c4001-1
0.227
DRA-CSI-47e38074-14
0.227
ASH-UNK-40b46b30-4
0.226
MIC-UNK-bcd487e9-2
0.226
IND-SYN-8bc6954a-2
0.226
MAR-TRE-f6f5f473-53
0.225
MAK-UNK-3e0761f8-8
0.225
DUN-NEW-f8ce3686-25
0.223
SID-ELM-b654bfa2-20
0.223
MAR-TRE-92684b97-83
0.222
SAD-SAT-cefd50cc-5
0.222
BAR-COM-4e090d3a-55
0.222
SID-ELM-2583a2cd-21
0.221
SID-ELM-b654bfa2-12
0.221
PET-SGC-a9e9d4f4-1
0.220
GIA-UNK-d2defdc3-7
0.220
MAT-UCB-70f7c0f7-5
0.219
NIM-UNI-310206f0-46
0.219
GIA-UNK-5ec6c2b8-1
0.218
FRA-LAB-04e32718-1
0.218
MED-UNK-e6e8ef8a-8
0.218
DRA-CSI-47e38074-9
0.216
JOE-SYG-2c9a1216-1
0.216
ADA-UCB-dc2b944c-17
0.216
CHA-KIN-ceadbd93-2
0.216
SID-ELM-b654bfa2-21
0.216
NIM-UNI-310206f0-27
0.215
MAT-POS-173a45da-1
0.215
JAL-FNM-0d3e14c0-1
0.214
AAR-POS-0daf6b7e-5
0.214
SAL-INS-1c7a5a55-7
0.214
MAK-UNK-0955449e-25
0.214
AHN-SAT-de2502ba-2
0.213
MAR-TRE-6a44bbf2-30
0.213
GIA-UNK-20b63697-6
0.213
ALP-POS-64a710fa-1
0.213
WIL-UNI-1faa9b10-13
0.213
MAR-TRE-9d18ae8c-70
0.213
MAK-UNK-8fdbca50-25
0.213
MAR-LAB-ff9967db-33
0.212
NJA-MAN-b8640440-50
0.212
JUA-UNI-b93289a4-4
0.212