Molecular Properties | |
SMILES: | CCNC(=O)NCC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1 |
MW: | 355.16 |
Fraction sp3: | 0.17 |
HBA: | 3 |
HBD: | 5 |
Rotatable Bonds: | 6 |
TPSA: | 111.36 |
cLogP: | 2.59 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Long aliphatic chain
Dipeptide
AAR-UNI-c25c2f1e-65
0.419
AAR-UNI-c25c2f1e-39
0.418
AAR-UNI-c25c2f1e-31
0.413
AAR-UNI-c25c2f1e-30
0.411
SID-ELM-2583a2cd-6
0.403
AAR-UNI-c25c2f1e-46
0.370
PET-SGC-0f1d26ed-2
0.368
MAR-TRE-9d18ae8c-52
0.366
MAR-TRE-4f781e27-49
0.361
PET-SGC-0f1d26ed-1
0.354
AAR-UNI-c25c2f1e-52
0.353
SID-ELM-2583a2cd-7
0.352
ALE-HEI-f28a35b5-1
0.352
TRY-UNI-714a760b-4
0.352
AAR-POS-d2a4d1df-11
0.348
SID-ELM-2583a2cd-5
0.348
SID-ELM-b654bfa2-3
0.342
AAR-UNI-c25c2f1e-75
0.341
GIA-UNK-3f36037a-7
0.338
SID-ELM-8b394441-7
0.338
AAR-UNI-c25c2f1e-16
0.338
AAR-UNI-c25c2f1e-71
0.338
MAX-MCD-16e3709a-1
0.333
SAD-SAT-6b5a89f0-8
0.333
AAR-UNI-c25c2f1e-78
0.329
AAR-UNI-c25c2f1e-82
0.329
MAK-UNK-129dcd6f-6
0.329
SID-ELM-b654bfa2-2
0.329
SID-ELM-8b394441-6
0.329
HAN-NEW-5f56c3bc-1
0.329
TRY-UNI-714a760b-8
0.324
MAK-UNK-129dcd6f-17
0.321
SID-ELM-8b394441-5
0.320
SID-ELM-b654bfa2-1
0.316
MAK-UNK-129dcd6f-16
0.314
WIL-UNI-5578df48-10
0.312
AAR-UNI-c25c2f1e-51
0.312
AAR-UNI-c25c2f1e-64
0.310
GIA-UNK-3f36037a-4
0.310
AAR-UNI-c25c2f1e-45
0.309
MAK-UNK-30aad1f1-16
0.306
WAR-XCH-79d12f6e-3
0.306
SID-ELM-b654bfa2-18
0.305
MAK-UNK-c8c8f7e2-17
0.304
WAR-XCH-b0339bbe-12
0.303
WAR-XCH-79d12f6e-1
0.303
MAK-UNK-129dcd6f-7
0.302
SID-ELM-8b394441-3
0.301
SID-ELM-8b394441-1
0.301
MAR-TRE-92684b97-89
0.301
SID-ELM-2583a2cd-10
0.300
MAR-TRE-14ce9fd6-61
0.300
AAR-UNI-c25c2f1e-100
0.300
WIL-UNI-5578df48-11
0.300
MAR-TRE-4f781e27-43
0.300
MAK-UNK-30aad1f1-3
0.299
WAR-XCH-eb7b662f-6
0.297
TAT-ENA-80bfd3e5-23
0.297
SID-ELM-b654bfa2-6
0.296
MAK-UNK-30aad1f1-17
0.296
WIL-UNI-5578df48-13
0.295
MAK-UNK-129dcd6f-15
0.294
SID-ELM-8b394441-14
0.293
AAR-UNI-c25c2f1e-8
0.292
WIL-LEE-23e8b574-6
0.292
MAK-UNK-129dcd6f-8
0.291
AAR-UNI-c25c2f1e-53
0.289
MAK-UNK-0cb6a3ad-11
0.286
MAR-TRE-e86a56b5-66
0.286
MAK-UNK-30aad1f1-2
0.284
SID-ELM-2583a2cd-14
0.284
SID-ELM-2583a2cd-8
0.284
WIL-UNI-5578df48-12
0.284
ANN-UNI-26382800-6
0.282
CHR-SOS-7098f804-8
0.282
MAK-UNK-129dcd6f-1
0.281
SID-ELM-2583a2cd-20
0.280
AAR-UNI-c25c2f1e-2
0.280
MIC-UNK-10ba69b4-2
0.280
NIC-UNI-0cb6411b-1
0.280
AAR-UNI-c25c2f1e-9
0.279
MAK-UNK-129dcd6f-18
0.278
AAR-UNI-c25c2f1e-21
0.278
AAR-UNI-c25c2f1e-35
0.277
DAR-DIA-03336633-11
0.277
AAR-UNI-c25c2f1e-18
0.276
MAR-TRE-7f7bb9f0-68
0.276
MAK-UNK-37f1d6fa-2
0.276
AAR-UNI-c25c2f1e-79
0.275
MIC-UNK-66895286-3
0.275
MAR-TRE-6a44bbf2-16
0.274
WAR-XCH-b0339bbe-20
0.274
WAR-XCH-79d12f6e-10
0.274
SID-ELM-b654bfa2-4
0.274
SID-ELM-8b394441-12
0.274
SID-ELM-8b394441-9
0.274
MIC-UNK-2744a8e2-2
0.272
AAR-UNI-c25c2f1e-87
0.272
MAK-UNK-51bb34f9-3
0.271
MAR-TRE-3e4e6814-62
0.271