Molecular Properties | |
SMILES: | O=C1C2C=CC=CC2[Se]N1c1ccc(F)cc1 |
MW: | 294.187 |
Fraction sp3: | 0.15 |
HBA: | 1 |
HBD: | 0 |
Rotatable Bonds: | 1 |
TPSA: | 20.31 |
cLogP: | 2.3222 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✔️ |
contains_metal
heavy metal
Any atoms except organogens, halogens, P, S, K, Na, Mg, Ca
Filter9_metal
Si,B,Se atoms
unacceptable atoms
Undesirable_Elements_Salts
AAR-POS-d2a4d1df-30
AMI-CSI-2339ae1c-2
0.686
AMI-CSI-2ea5bed6-4
0.648
AMI-CSI-2ea5bed6-11
0.636
AMI-CSI-2339ae1c-4
0.596
AMI-CSI-2339ae1c-3
0.561
AMI-CSI-2ea5bed6-1
0.536
AMI-CSI-2339ae1c-1
0.517
AMI-CSI-2ea5bed6-8
0.508
AMI-CSI-2ea5bed6-3
0.484
AMI-CSI-2ea5bed6-12
0.477
AMI-CSI-2ea5bed6-10
0.464
AMI-CSI-2ea5bed6-7
0.415
AMI-CSI-2ea5bed6-5
0.373
AMI-CSI-2ea5bed6-9
0.355
AMI-CSI-2ea5bed6-6
0.355
MAT-POS-162a9720-4
0.224
CHR-GRO-51f79798-4
0.224
DEM-REL-172c3d60-4
0.202
HAO-BIO-c9aafde3-1
0.198
DRR-IMP-db50bf6e-1
0.186
GIA-UNK-995df016-16
0.184
BEN-DND-7e92b6ca-14
0.184
BUT-UNK-efbf8c2c-1
0.184
WAR-XCH-b6889685-57
0.177
WAR-XCH-b6889685-26
0.177
GER-UNI-caecb3b0-1
0.176
MAT-POS-b5746674-127
0.175
GAB-REV-df64cf17-9
0.174
MAR-TRE-3e4e6814-75
0.174
MAR-TRE-4b834d9a-54
0.173
MAR-TRE-4b834d9a-60
0.172
MAR-TRE-3e4e6814-20
0.172
MAT-POS-b5746674-126
0.172
MAR-TRE-74c6519b-26
0.171
WAR-XCH-b72a1bbc-44
0.171
MAR-TRE-7f7bb9f0-22
0.170
MAK-UNK-e0fdfe28-1
0.169
LOR-NOR-30067bb9-1
0.169
JAN-GHE-4287bd1a-6
0.169
MAT-POS-fa06b69f-3
0.167
MAR-TRE-6a44bbf2-39
0.167
MAR-TRE-a3327163-54
0.167
WAR-XCH-b6889685-5
0.167
MAR-TRE-7f7bb9f0-78
0.167
MAK-UNK-9e4a73aa-4
0.167
TAT-ENA-80bfd3e5-4
0.167
DEM-REL-172c3d60-2
0.167
AAR-POS-d2a4d1df-33
0.167
MAR-TRE-b77b7921-59
0.165
LON-WEI-b2874fec-10
0.165
WAR-XCH-b6889685-48
0.165
AHN-SAT-02ef6d10-2
0.165
IAN-BAS-8ad3d156-1
0.163
MAT-POS-11ebe265-1
0.163
MEV-UNK-0bf23af6-1
0.163
MAT-POS-ea426761-68
0.163
LON-WEI-5e7d1b3e-2
0.163
LON-WEI-4d77710c-2
0.163
MAR-TRE-e86a56b5-95
0.163
JAN-GHE-83b26c96-18
0.163
NAU-LAT-ec9c7557-5
0.162
MAR-TRE-4b834d9a-35
0.162
MAR-TRE-2fd8122f-10
0.161
MAR-TRE-4b834d9a-42
0.161
MAR-TRE-7f7bb9f0-65
0.161
LON-WEI-b2874fec-14
0.161
VID-DNY-1d288c6c-11
0.161
MAR-TRE-0fda4e82-16
0.161
BEN-DND-03406596-8
0.160
NIM-UNI-0ea3b7bf-5
0.160
MAR-TRE-6a44bbf2-58
0.160
KAY-MCD-d0fe5261-1
0.160
MAR-TRE-d0525fbf-21
0.160
DRR-IMP-dff87f5e-1
0.160
MAR-TRE-4b834d9a-76
0.160
LOR-NOR-f9b26152-1
0.159
MAT-POS-b5746674-57
0.159
ALV-UNI-7ff1a6f9-3
0.159
DRV-DNY-ae159ed1-2
0.159
MAK-UNK-b1d4dcd7-8
0.158
MAR-TRE-9c797165-78
0.158
MAR-TRE-67513f76-23
0.158
DEM-REL-172c3d60-7
0.158
WIL-UNI-d4749f31-15
0.158
MAR-TRE-7f7bb9f0-58
0.158
MAK-UNK-10572812-5
0.157
DRV-DNY-3e405af9-1
0.157
MAR-TRE-fffca54f-28
0.157
MAR-TRE-67513f76-62
0.157
MAR-TRE-8a25d817-24
0.157
WIL-UNI-1faa9b10-5
0.157
MAR-TRE-66ac689e-42
0.157
AAR-POS-0daf6b7e-8
0.156
CAS-DEP-751a2458-6
0.156
DEM-REL-172c3d60-5
0.156
DEM-REL-172c3d60-3
0.156
BRU-UNI-418e22dc-1
0.155
MAR-TRE-74c6519b-70
0.155
MAR-TRE-7f7bb9f0-70
0.155
PET-UNK-4dc48bbe-7
0.155