Molecular Properties | |
SMILES: | C[C@]1(c2cccc(CNc3ccc4nnc(-c5ccccc5F)n4n3)c2)NC(=O)NC1=O |
MW: | 431.15 |
Fraction sp3: | 0.14 |
HBA: | 7 |
HBD: | 3 |
Rotatable Bonds: | 5 |
TPSA: | 113.31 |
cLogP: | 2.6 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
hydantoin
MAR-TRE-66ac689e-1
0.388
VLA-UNK-c3e99b7a-6
0.385
VLA-UNK-c3e99b7a-10
0.375
VLA-UNK-c3e99b7a-2
0.374
VLA-UNK-c3e99b7a-4
0.341
MAK-UNK-148caf23-18
0.305
WIL-UNI-d4749f31-5
0.303
MAR-TRE-66ac689e-8
0.278
VLA-UNK-c3e99b7a-8
0.277
MAK-UNK-0955449e-26
0.264
MAK-UNK-0955449e-27
0.264
BEN-BAS-43e7cce2-1
0.259
MAK-UNK-148caf23-12
0.254
MAK-UNK-0955449e-16
0.248
MAK-UNK-0955449e-15
0.246
MAK-UNK-9a6be56d-15
0.245
MAK-UNK-148caf23-16
0.244
MAK-UNK-0955449e-30
0.244
MAK-UNK-148caf23-19
0.243
MAK-UNK-0955449e-13
0.239
MAK-UNK-148caf23-2
0.237
WIL-UNI-2a57d06c-34
0.237
MAK-UNK-148caf23-15
0.237
MAK-UNK-148caf23-17
0.237
MAK-UNK-0955449e-31
0.235
MAK-UNK-148caf23-3
0.232
MAR-TRE-66ac689e-38
0.231
MAK-UNK-148caf23-1
0.230
MAK-UNK-0955449e-11
0.229
MAK-UNK-0955449e-6
0.226
MAK-UNK-9a6be56d-26
0.226
MAK-UNK-148caf23-9
0.225
MAK-UNK-0955449e-24
0.224
MAK-UNK-9a6be56d-12
0.224
MAK-UNK-0955449e-28
0.223
MAK-UNK-0955449e-17
0.223
MAK-UNK-148caf23-14
0.223
MAK-UNK-9a6be56d-5
0.221
MAK-UNK-0955449e-23
0.220
MAK-UNK-0955449e-25
0.220
MAK-UNK-702fb7d3-13
0.219
MAK-UNK-0955449e-21
0.219
MAK-UNK-9a6be56d-31
0.219
MAK-UNK-9a6be56d-29
0.219
MAR-LAB-ff9967db-33
0.218
MAK-UNK-9a6be56d-28
0.218
MAK-UNK-9a6be56d-19
0.218
MAK-UNK-0955449e-8
0.217
MAK-UNK-0955449e-9
0.217
MAK-UNK-9a6be56d-18
0.217
MAK-UNK-0955449e-2
0.216
MAK-UNK-148caf23-5
0.216
MAK-UNK-702fb7d3-12
0.216
MAK-UNK-9a6be56d-10
0.215
MAK-UNK-148caf23-4
0.214
MAK-UNK-148caf23-8
0.214
MAK-UNK-9a6be56d-17
0.214
MAK-UNK-de9577cf-15
0.213
MAK-UNK-148caf23-11
0.213
MAK-UNK-0955449e-20
0.212
MAK-UNK-9a6be56d-11
0.212
MAK-UNK-148caf23-7
0.211
MAK-UNK-0955449e-7
0.211
MAK-UNK-9a6be56d-14
0.211
MAK-UNK-9a6be56d-16
0.211
MAK-UNK-de9577cf-1
0.210
MAK-UNK-0955449e-29
0.210
MAK-UNK-8fdbca50-21
0.209
MAK-UNK-8fdbca50-33
0.208
MAR-TRE-3e4e6814-95
0.208
MAK-UNK-702fb7d3-11
0.208
MAK-UNK-0955449e-3
0.206
MAK-UNK-0955449e-19
0.206
MAK-UNK-8fdbca50-10
0.205
MAK-UNK-9a6be56d-8
0.204
MAK-UNK-9a6be56d-27
0.204
MAK-UNK-9a6be56d-32
0.204
MAK-UNK-8fdbca50-19
0.204
MAK-UNK-8fdbca50-40
0.204
MAK-UNK-8fdbca50-6
0.204
MAK-UNK-9a6be56d-25
0.204
MAK-UNK-8fdbca50-34
0.204
MAK-UNK-0955449e-22
0.203
MAK-UNK-0955449e-10
0.203
MAK-UNK-8fdbca50-24
0.203
MAK-UNK-702fb7d3-9
0.203
MAK-UNK-148caf23-13
0.201
MAK-UNK-8fdbca50-25
0.201
MAK-UNK-148caf23-22
0.200
MAK-UNK-8fdbca50-20
0.200
MAK-UNK-8fdbca50-32
0.200
MAK-UNK-8fdbca50-41
0.200
MAK-UNK-0955449e-12
0.200
MAK-UNK-0955449e-14
0.200
MAK-UNK-702fb7d3-8
0.199
MAK-UNK-8fdbca50-35
0.199
MAK-UNK-9a6be56d-3
0.199
MAK-UNK-8fdbca50-23
0.199
MAK-UNK-de9577cf-20
0.199
VIT-UNK-2a0afa28-2
0.198