Molecular Properties | |
SMILES: | Cc1ccc2c(-c3cccnc3)c(-c3ccc(F)cc3)nn2n1 |
MW: | 304.328 |
Fraction sp3: | 0.06 |
HBA: | 4 |
HBD: | 0 |
Rotatable Bonds: | 2 |
TPSA: | 43.08 |
cLogP: | 3.90582 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✔️ |
ALV-UNI-7ff1a6f9-2
0.667
ALV-UNI-7ff1a6f9-35
0.638
ALV-UNI-7ff1a6f9-33
0.614
ALV-UNI-7ff1a6f9-34
0.597
ALV-UNI-7ff1a6f9-31
0.564
ALV-UNI-7ff1a6f9-30
0.558
ALV-UNI-7ff1a6f9-32
0.548
ALV-UNI-7ff1a6f9-36
0.542
ALV-UNI-7ff1a6f9-29
0.506
ALV-UNI-7ff1a6f9-6
0.494
ALV-UNI-7ff1a6f9-11
0.468
ALV-UNI-7ff1a6f9-38
0.386
ALV-UNI-7ff1a6f9-43
0.383
ALV-UNI-7ff1a6f9-8
0.369
MAT-POS-b5746674-121
0.357
ALV-UNI-7ff1a6f9-1
0.354
ALV-UNI-7ff1a6f9-10
0.314
ALV-UNI-7ff1a6f9-24
0.303
ALV-UNI-7ff1a6f9-26
0.300
ALV-UNI-7ff1a6f9-27
0.295
ALV-UNI-7ff1a6f9-28
0.292
DRV-DNY-3e405af9-5
0.289
ALV-UNI-7ff1a6f9-25
0.287
ALV-UNI-7ff1a6f9-22
0.281
ALV-UNI-7ff1a6f9-23
0.281
ALV-UNI-7ff1a6f9-12
0.278
WAR-XCH-bdd24732-17
0.275
ALV-UNI-7ff1a6f9-21
0.265
ALV-UNI-7ff1a6f9-42
0.253
ALV-UNI-7ff1a6f9-7
0.247
ALV-UNI-7ff1a6f9-37
0.247
MAR-TRE-b77b7921-49
0.240
ALV-UNI-7ff1a6f9-19
0.239
AGN-NEW-891393a6-6
0.239
ALV-UNI-7ff1a6f9-3
0.239
MAR-TRE-3e4e6814-66
0.237
ALV-UNI-7ff1a6f9-20
0.236
KEI-TRE-d5e2018a-62
0.235
ALV-UNI-7ff1a6f9-4
0.233
MAK-UNK-a7b37c5e-5
0.232
ALV-UNI-7ff1a6f9-13
0.232
AUS-ARG-7cfdce8f-6
0.231
NAU-LAT-445f63e5-2
0.229
ALV-UNI-7ff1a6f9-40
0.228
ALV-UNI-7ff1a6f9-17
0.228
KEI-TRE-d5e2018a-42
0.228
ALV-UNI-7ff1a6f9-18
0.226
ALV-UNI-7ff1a6f9-41
0.226
ISA-SCH-8e98219b-1
0.225
ALV-UNI-7ff1a6f9-16
0.220
MAR-TRE-1c920f6f-64
0.220
MAT-POS-b5746674-127
0.219
ALV-UNI-7ff1a6f9-15
0.218
MAR-TRE-74c6519b-30
0.217
MAR-TRE-f6f5f473-17
0.217
MAK-UNK-9e4a73aa-34
0.216
MAR-TRE-b77b7921-7
0.216
MAR-TRE-7f7bb9f0-56
0.216
MAR-TRE-d0525fbf-97
0.216
MAR-TRE-4b834d9a-18
0.215
MAR-TRE-04c86cea-73
0.215
MAR-TRE-c8530538-44
0.214
AUS-ARG-7cfdce8f-5
0.214
RAI-NOV-c18e0037-5
0.212
MAR-TRE-a3327163-85
0.212
MAR-TRE-74c6519b-26
0.212
FRA-BIO-8bf1eac9-1
0.212
ALV-UNI-7ff1a6f9-9
0.212
ALV-UNI-7ff1a6f9-44
0.212
ALV-UNI-7ff1a6f9-39
0.212
MAT-POS-ea426761-57
0.211
ALV-UNI-7ff1a6f9-14
0.210
MAR-TRE-7f7bb9f0-93
0.210
ALE-HEI-f28a35b5-5
0.209
KTA-UNK-ec872bc6-5
0.209
MAK-UNK-9e4a73aa-33
0.208
AUS-ARG-7cfdce8f-9
0.208
KTA-UNK-dac325de-1
0.208
MAR-TRE-74c6519b-2
0.207
ROM-UNK-ef52a3c9-1
0.207
MAR-TRE-a3327163-5
0.206
AUS-ARG-7cfdce8f-10
0.206
FOC-CAS-e3a94da8-1
0.206
MAK-UNK-9e4a73aa-32
0.206
MAK-UNK-2c1752f0-2
0.205
DAR-DIA-5d6f1b43-33
0.205
JAR-KUA-8c13982c-1
0.204
WIL-UNI-5578df48-1
0.202
AGN-NEW-891393a6-7
0.202
HUB-UNK-9845d277-14
0.202
BAR-COM-4e090d3a-1
0.202
ASH-UNK-40b46b30-1
0.200
WIL-UNI-5578df48-7
0.200
MAK-UNK-9e4a73aa-35
0.200
WAR-XCH-b72a1bbc-4
0.200
MAR-TRE-f6f5f473-79
0.200
ALP-POS-e980f4ea-26
0.198
MAK-UNK-de9577cf-9
0.198
MAR-TRE-04c86cea-35
0.198
WAR-XCH-79d12f6e-12
0.198