Molecular Properties | |
SMILES: | Cc1cnc2c(c1)nc(-c1ccc(F)cc1)n2-c1ccncc1 |
MW: | 304.328 |
Fraction sp3: | 0.06 |
HBA: | 4 |
HBD: | 0 |
Rotatable Bonds: | 2 |
TPSA: | 43.6 |
cLogP: | 3.93002 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✔️ |
ALV-UNI-7ff1a6f9-3
0.514
ALV-UNI-7ff1a6f9-10
0.325
ALV-UNI-7ff1a6f9-7
0.301
ALV-UNI-7ff1a6f9-42
0.293
ALV-UNI-7ff1a6f9-2
0.289
ALV-UNI-7ff1a6f9-37
0.271
ALV-UNI-7ff1a6f9-1
0.271
ALV-UNI-7ff1a6f9-11
0.270
ALV-UNI-7ff1a6f9-25
0.267
ALV-UNI-7ff1a6f9-26
0.267
MAT-POS-b5746674-121
0.261
ALV-UNI-7ff1a6f9-18
0.261
ALV-UNI-7ff1a6f9-8
0.258
ALV-UNI-7ff1a6f9-28
0.258
ALV-UNI-7ff1a6f9-24
0.256
ALV-UNI-7ff1a6f9-17
0.250
ALV-UNI-7ff1a6f9-23
0.250
ALV-UNI-7ff1a6f9-22
0.250
ALV-UNI-7ff1a6f9-12
0.247
ALV-UNI-7ff1a6f9-19
0.247
ALV-UNI-7ff1a6f9-27
0.247
ALV-UNI-7ff1a6f9-9
0.242
ALV-UNI-7ff1a6f9-13
0.239
ALV-UNI-7ff1a6f9-43
0.239
ALV-UNI-7ff1a6f9-35
0.236
MAR-TRE-7f7bb9f0-78
0.234
ALV-UNI-7ff1a6f9-5
0.233
ALV-UNI-7ff1a6f9-41
0.233
ALV-UNI-7ff1a6f9-34
0.231
ALV-UNI-7ff1a6f9-38
0.231
ALV-UNI-7ff1a6f9-20
0.230
ALV-UNI-7ff1a6f9-14
0.229
MAR-TRE-67513f76-11
0.228
MAR-TRE-74c6519b-70
0.226
MAR-TRE-f6f5f473-17
0.223
MAR-TRE-74c6519b-30
0.223
ALV-UNI-7ff1a6f9-33
0.222
ALV-UNI-7ff1a6f9-40
0.222
ALV-UNI-7ff1a6f9-21
0.222
ALV-UNI-7ff1a6f9-30
0.219
MAR-TRE-3e4e6814-66
0.219
ALV-UNI-7ff1a6f9-44
0.218
ALV-UNI-7ff1a6f9-39
0.218
MAR-TRE-7f7bb9f0-93
0.216
ALV-UNI-7ff1a6f9-16
0.214
ALV-UNI-7ff1a6f9-31
0.214
ALV-UNI-7ff1a6f9-36
0.213
ALV-UNI-7ff1a6f9-15
0.212
MAR-TRE-3e4e6814-4
0.211
ALV-UNI-7ff1a6f9-6
0.210
MAR-TRE-4b834d9a-18
0.210
ALV-UNI-7ff1a6f9-32
0.209
MAR-TRE-9c797165-100
0.207
BEN-DND-93268d01-5
0.207
KEI-TRE-d5e2018a-62
0.206
MAK-UNK-9e4a73aa-19
0.204
MAR-TRE-9c797165-92
0.204
MAR-TRE-74c6519b-39
0.204
MAR-TRE-66ac689e-58
0.202
DRV-DNY-3e405af9-6
0.202
MAR-TRE-b77b7921-20
0.202
DAN-RED-da448e80-8
0.200
MAR-TRE-b77b7921-7
0.200
KOV-VNK-5e1a909f-25
0.200
MAR-TRE-d0525fbf-70
0.198
MAR-TRE-9c797165-85
0.198
MAR-TRE-04c86cea-73
0.198
MAR-TRE-9c797165-78
0.198
MAR-TRE-67513f76-23
0.198
WIL-UNI-d4749f31-15
0.198
MAR-TRE-a3327163-93
0.198
MAT-POS-b5746674-57
0.197
MAR-TRE-7f7bb9f0-22
0.196
MAR-TRE-d0525fbf-37
0.196
MAR-TRE-74c6519b-86
0.196
MAR-TRE-c317dd82-24
0.196
VLA-UNK-c3e99b7a-6
0.195
MAR-TRE-d0525fbf-71
0.195
MAR-TRE-d0525fbf-94
0.194
STE-UNK-28609fce-1
0.194
JAR-KUA-8c13982c-14
0.194
KOV-VNK-5e1a909f-26
0.193
MAR-TRE-7f7bb9f0-73
0.193
MAR-TRE-7f7bb9f0-70
0.193
MAR-TRE-f6f5f473-22
0.193
MAR-TRE-04c86cea-80
0.192
ALP-POS-95b75b4d-1
0.191
MAR-TRE-d0525fbf-89
0.191
MAT-POS-ea426761-1
0.190
CAS-DEP-751a2458-6
0.190
GAB-REV-df64cf17-8
0.190
MAR-TRE-7f7bb9f0-65
0.190
MAR-TRE-3e4e6814-75
0.190
ALV-UNI-7ff1a6f9-29
0.190
JOH-UNI-abfda500-2
0.189
WAR-XCH-bdd24732-17
0.189
JOH-UNI-61f30276-3
0.189
MAR-TRE-74c6519b-64
0.189
DAR-DIA-5d6f1b43-15
0.189
MAR-TRE-4b834d9a-60
0.188