Molecular Properties | |
SMILES: | Cc1cnc2c(-c3cccnc3)c(-c3ccc(F)cc3)nn2c1 |
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-7ff1a6f9-10
0.691
ALV-UNI-7ff1a6f9-27
0.657
ALV-UNI-7ff1a6f9-25
0.652
ALV-UNI-7ff1a6f9-26
0.630
ALV-UNI-7ff1a6f9-23
0.582
ALV-UNI-7ff1a6f9-24
0.573
ALV-UNI-7ff1a6f9-22
0.562
ALV-UNI-7ff1a6f9-28
0.560
ALV-UNI-7ff1a6f9-12
0.537
ALV-UNI-7ff1a6f9-21
0.518
ALV-UNI-7ff1a6f9-5
0.468
ALV-UNI-7ff1a6f9-1
0.378
ALV-UNI-7ff1a6f9-43
0.373
MAT-POS-b5746674-121
0.365
ALV-UNI-7ff1a6f9-8
0.360
ALV-UNI-7ff1a6f9-38
0.360
ALV-UNI-7ff1a6f9-35
0.307
ALV-UNI-7ff1a6f9-2
0.302
ALV-UNI-7ff1a6f9-33
0.292
ALV-UNI-7ff1a6f9-6
0.286
ALV-UNI-7ff1a6f9-34
0.286
DRV-DNY-3e405af9-5
0.283
ALV-UNI-7ff1a6f9-31
0.278
ALV-UNI-7ff1a6f9-32
0.278
ALV-UNI-7ff1a6f9-4
0.270
ALV-UNI-7ff1a6f9-36
0.270
ALV-UNI-7ff1a6f9-29
0.265
MAT-POS-ea426761-57
0.258
MAR-TRE-3e4e6814-66
0.258
ALV-UNI-7ff1a6f9-30
0.258
WAR-XCH-bdd24732-17
0.255
ALV-UNI-7ff1a6f9-19
0.247
ALV-UNI-7ff1a6f9-42
0.247
KEI-TRE-d5e2018a-62
0.243
ALV-UNI-7ff1a6f9-7
0.242
MAK-UNK-a7b37c5e-5
0.241
AUS-ARG-7cfdce8f-6
0.239
MAR-TRE-b77b7921-49
0.235
ISA-SCH-8e98219b-1
0.235
ALV-UNI-7ff1a6f9-18
0.234
ALV-UNI-7ff1a6f9-9
0.231
ALV-UNI-7ff1a6f9-20
0.231
ALV-UNI-7ff1a6f9-44
0.231
ALV-UNI-7ff1a6f9-37
0.228
ALV-UNI-7ff1a6f9-16
0.228
ALV-UNI-7ff1a6f9-13
0.227
MAT-POS-b5746674-127
0.226
MAR-TRE-7f7bb9f0-56
0.225
MAK-UNK-9e4a73aa-34
0.224
MAR-TRE-74c6519b-30
0.224
MAR-TRE-f6f5f473-17
0.224
NAU-LAT-445f63e5-2
0.224
KEI-TRE-d5e2018a-42
0.223
ALV-UNI-7ff1a6f9-17
0.223
MAR-TRE-d0525fbf-97
0.223
MAR-TRE-4b834d9a-18
0.222
JAR-KUA-8c13982c-1
0.222
AGN-NEW-891393a6-6
0.221
ALV-UNI-7ff1a6f9-41
0.221
MAR-TRE-a3327163-85
0.221
ASH-UNK-40b46b30-1
0.220
FRA-BIO-8bf1eac9-1
0.219
ALV-UNI-7ff1a6f9-39
0.219
MAR-TRE-7f7bb9f0-93
0.217
ROM-UNK-ef52a3c9-1
0.216
AUS-ARG-7cfdce8f-9
0.216
MAR-TRE-4b834d9a-42
0.216
MAR-TRE-2fd8122f-10
0.216
AUS-ARG-7cfdce8f-10
0.214
FOC-CAS-e3a94da8-1
0.214
ALV-UNI-7ff1a6f9-15
0.214
MAR-TRE-85681e92-95
0.212
MAR-TRE-b77b7921-7
0.212
MAR-TRE-7f7bb9f0-58
0.212
WIL-UNI-5578df48-1
0.211
MAR-TRE-04c86cea-73
0.211
ALV-UNI-7ff1a6f9-40
0.211
AGN-NEW-891393a6-7
0.210
HUB-UNK-9845d277-14
0.210
AUS-ARG-7cfdce8f-5
0.210
WIL-UNI-5578df48-33
0.210
WIL-UNI-5578df48-7
0.209
MAK-UNK-148caf23-23
0.208
MAK-UNK-9e4a73aa-35
0.208
STE-UNK-28609fce-1
0.208
MAR-TRE-74c6519b-26
0.207
MAR-TRE-87acfbcc-66
0.207
ALV-UNI-7ff1a6f9-3
0.207
ALP-POS-95f71980-40
0.206
WAR-XCH-79d12f6e-12
0.206
MAR-TRE-04c86cea-35
0.206
ALV-UNI-7ff1a6f9-14
0.206
MAR-TRE-04c86cea-80
0.206
MAK-UNK-0955449e-33
0.206
MAR-TRE-74c6519b-70
0.205
DAR-DIA-842b4336-11
0.205
ALE-HEI-f28a35b5-5
0.205
KEI-TRE-d5e2018a-55
0.204
MAK-UNK-9e4a73aa-33
0.204
MAR-TRE-4b834d9a-14
0.204