Molecular Properties | |
SMILES: | CC(C)(C)NC(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1 |
MW: | 340.19 |
Fraction sp3: | 0.26 |
HBA: | 2 |
HBD: | 4 |
Rotatable Bonds: | 4 |
TPSA: | 82.26 |
cLogP: | 3.93 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
AAR-UNI-c25c2f1e-65
0.621
MAR-TRE-9d18ae8c-52
0.562
AAR-UNI-c25c2f1e-82
0.551
AAR-UNI-c25c2f1e-2
0.466
AAR-UNI-c25c2f1e-35
0.459
AAR-UNI-c25c2f1e-78
0.446
MAR-TRE-9d18ae8c-43
0.432
AAR-UNI-c25c2f1e-40
0.413
AAR-UNI-c25c2f1e-18
0.412
AAR-UNI-c25c2f1e-30
0.382
MAR-TRE-9d18ae8c-18
0.378
MAR-TRE-799db12b-97
0.376
RAL-MED-2de63afb-12
0.372
SID-ELM-2583a2cd-6
0.371
AAR-UNI-c25c2f1e-3
0.361
AAR-UNI-c25c2f1e-8
0.360
AAR-UNI-c25c2f1e-46
0.360
WIL-UNI-1faa9b10-23
0.359
MAR-TRE-9d18ae8c-53
0.358
MAK-UNK-30aad1f1-6
0.356
AAR-UNI-c25c2f1e-51
0.355
MAR-TRE-799db12b-16
0.354
MAR-TRE-799db12b-27
0.354
MAK-UNK-30aad1f1-3
0.353
MAR-TRE-799db12b-51
0.349
MAR-TRE-66ac689e-37
0.346
MAR-TRE-92684b97-6
0.345
TRY-UNI-714a760b-4
0.342
ALE-HEI-f28a35b5-1
0.342
SID-ELM-2583a2cd-7
0.342
PET-SGC-0f1d26ed-2
0.342
ERI-BAS-bd3ef700-1
0.340
AAR-POS-d2a4d1df-11
0.338
SID-ELM-2583a2cd-5
0.338
WIL-UNI-5578df48-26
0.337
AAR-UNI-c25c2f1e-24
0.337
BAR-COM-21d20d65-6
0.333
MAR-TRE-9d18ae8c-11
0.333
BAR-COM-21d20d65-2
0.330
MAR-TRE-799db12b-2
0.329
MAR-TRE-799db12b-3
0.329
MAR-TRE-799db12b-24
0.329
MAR-TRE-799db12b-33
0.329
MAR-TRE-9d18ae8c-54
0.329
BAR-COM-4e090d3a-61
0.326
BAR-COM-21d20d65-4
0.326
MAK-UNK-129dcd6f-7
0.326
MAR-TRE-4f781e27-2
0.326
MAR-TRE-9d18ae8c-30
0.326
WIL-UNI-5578df48-28
0.325
WIL-UNI-5578df48-11
0.325
MAX-MCD-16e3709a-1
0.323
BAR-COM-21d20d65-5
0.322
MAR-TRE-9d18ae8c-7
0.322
MAK-UNK-129dcd6f-6
0.321
SID-ELM-b654bfa2-3
0.316
NIC-UNI-0cb6411b-1
0.315
PET-SGC-0f1d26ed-1
0.313
SID-ELM-8b394441-7
0.312
MAR-TRE-9d18ae8c-10
0.311
WIL-UNI-5578df48-25
0.311
BAR-COM-21d20d65-8
0.310
AAR-UNI-c25c2f1e-100
0.309
SAD-SAT-135344c3-7
0.308
MAR-TRE-799db12b-76
0.308
MAK-UNK-30aad1f1-2
0.307
MAK-UNK-129dcd6f-16
0.307
WES-WAB-2b40d25a-1
0.304
SID-ELM-b654bfa2-2
0.304
WIL-UNI-5578df48-10
0.304
SID-ELM-8b394441-6
0.304
BAR-COM-21d20d65-3
0.303
HAN-NEW-5f56c3bc-1
0.303
MAK-UNK-129dcd6f-15
0.302
MAR-TRE-799db12b-4
0.301
MAR-TRE-9d18ae8c-34
0.300
MAR-TRE-799db12b-14
0.300
MAK-UNK-129dcd6f-17
0.299
TRY-UNI-714a760b-8
0.299
AAR-UNI-c25c2f1e-71
0.298
BAR-COM-21d20d65-1
0.297
BAR-COM-21d20d65-7
0.297
WIL-UNI-5578df48-27
0.297
AAR-UNI-c25c2f1e-53
0.297
AAR-UNI-c25c2f1e-16
0.296
WIL-UNI-5578df48-22
0.296
WIL-UNI-5578df48-24
0.295
BAR-COM-21d20d65-9
0.295
WIL-UNI-5578df48-21
0.295
WAR-XCH-b0339bbe-12
0.295
WAR-XCH-79d12f6e-1
0.295
SID-ELM-8b394441-5
0.295
MAR-TRE-9d18ae8c-16
0.293
SID-ELM-8b394441-3
0.293
SID-ELM-8b394441-1
0.293
WIL-UNI-5578df48-12
0.293
SID-ELM-2583a2cd-10
0.293
SID-ELM-b654bfa2-1
0.291
BAR-COM-4e090d3a-11
0.291
WIL-UNI-5578df48-29
0.290