Molecular Properties | |
SMILES: | Cc1ccc2c(c1)nc(-c1ccc(F)cc1)n2-c1ccncc1 |
MW: | 303.34 |
Fraction sp3: | 0.05 |
HBA: | 3 |
HBD: | 0 |
Rotatable Bonds: | 2 |
TPSA: | 30.71 |
cLogP: | 4.53502 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✔️ |
ALV-UNI-7ff1a6f9-4
0.514
ALV-UNI-7ff1a6f9-7
0.342
ALV-UNI-7ff1a6f9-1
0.325
ALV-UNI-7ff1a6f9-2
0.312
ALV-UNI-7ff1a6f9-37
0.309
ALV-UNI-7ff1a6f9-42
0.300
ALV-UNI-7ff1a6f9-17
0.271
ALV-UNI-7ff1a6f9-8
0.264
ALV-UNI-7ff1a6f9-10
0.256
ALV-UNI-7ff1a6f9-20
0.250
ALV-UNI-7ff1a6f9-13
0.244
ALV-UNI-7ff1a6f9-40
0.241
ALV-UNI-7ff1a6f9-19
0.239
ALV-UNI-7ff1a6f9-5
0.239
ALV-UNI-7ff1a6f9-18
0.239
ALV-UNI-7ff1a6f9-34
0.236
ALV-UNI-7ff1a6f9-38
0.236
ALV-UNI-7ff1a6f9-9
0.235
ALV-UNI-7ff1a6f9-14
0.234
ALV-UNI-7ff1a6f9-36
0.233
ALV-UNI-7ff1a6f9-43
0.230
ALV-UNI-7ff1a6f9-15
0.229
ALV-UNI-7ff1a6f9-32
0.227
ALV-UNI-7ff1a6f9-35
0.227
ALV-UNI-7ff1a6f9-30
0.223
MAT-POS-b5746674-57
0.219
DRV-DNY-3e405af9-6
0.219
ALV-UNI-7ff1a6f9-16
0.219
ALV-UNI-7ff1a6f9-31
0.219
ALV-UNI-7ff1a6f9-26
0.217
MAR-TRE-74c6519b-30
0.216
ALV-UNI-7ff1a6f9-33
0.213
MAT-POS-b5746674-121
0.211
ALV-UNI-7ff1a6f9-41
0.211
MAK-UNK-9e4a73aa-19
0.209
MAR-TRE-67513f76-11
0.208
MAR-TRE-74c6519b-70
0.208
ALV-UNI-7ff1a6f9-11
0.207
MAT-POS-ea426761-1
0.206
ALV-UNI-7ff1a6f9-23
0.204
ALV-UNI-7ff1a6f9-22
0.204
MAR-TRE-f6f5f473-17
0.204
MAK-UNK-9e4a73aa-34
0.202
ALV-UNI-7ff1a6f9-6
0.202
MAR-TRE-1c920f6f-52
0.200
MAR-TRE-7f7bb9f0-78
0.200
WIL-UNI-d4749f31-39
0.198
ALV-UNI-7ff1a6f9-39
0.198
KEI-TRE-d5e2018a-62
0.198
MAR-TRE-3e4e6814-66
0.198
BEN-DND-93268d01-5
0.198
KOV-VNK-5e1a909f-26
0.197
ALV-UNI-7ff1a6f9-28
0.196
MAT-POS-b5746674-127
0.194
ALV-UNI-7ff1a6f9-29
0.194
MAR-TRE-7f7bb9f0-65
0.194
ALV-UNI-7ff1a6f9-24
0.194
MAR-TRE-3e4e6814-4
0.193
UNK-UNK-2ede4078-15
0.192
MAR-TRE-3e4e6814-20
0.192
BAR-COM-0f94fc3d-18
0.189
MAR-TRE-a3327163-93
0.189
ALV-UNI-7ff1a6f9-25
0.189
MAR-TRE-74c6519b-86
0.189
WAR-XCH-b72a1bbc-2
0.188
VLA-UNK-c3e99b7a-6
0.188
LYN-UNI-b265e4fd-5
0.188
ALV-UNI-7ff1a6f9-44
0.186
MAT-POS-162a9720-10
0.185
ALV-UNI-7ff1a6f9-27
0.185
MAR-TRE-74c6519b-39
0.184
GER-UNI-05c7e912-1
0.184
MAR-TRE-b77b7921-20
0.183
KOV-VNK-5e1a909f-25
0.183
GAB-REV-df64cf17-8
0.182
WAR-XCH-bdd24732-17
0.181
MAR-TRE-d0525fbf-70
0.180
JON-UIO-d28d79fe-2
0.179
MAR-TRE-9c797165-85
0.179
KOV-VNK-5e1a909f-56
0.179
MAR-UCB-195bc32d-51
0.179
MAR-TRE-66ac689e-58
0.179
MAR-TRE-9c797165-100
0.179
ALV-UNI-7ff1a6f9-12
0.178
WIL-UNI-d4749f31-15
0.178
MAR-TRE-7f7bb9f0-58
0.178
MAR-TRE-9c797165-78
0.178
MAR-TRE-67513f76-23
0.178
MAR-TRE-7f7bb9f0-22
0.178
MAR-TRE-d0525fbf-71
0.177
DRV-DNY-3e405af9-5
0.176
WIL-UNI-d4749f31-17
0.176
MAR-TRE-7f7bb9f0-73
0.175
LYN-UNI-b265e4fd-2
0.174
MAR-TRE-f6f5f473-22
0.174
MAR-TRE-7f7bb9f0-70
0.174
MAR-TRE-c317dd82-24
0.174
MAR-TRE-1c920f6f-86
0.174
RAI-NOV-c18e0037-5
0.173
IND-SYN-a2b2ab0e-2
0.173