Molecular Properties | |
SMILES: | N[C@@H](Cc1ccc(O)cc1)C(=O)Nc1ccc2ccccc2c1 |
MW: | 306.14 |
Fraction sp3: | 0.11 |
HBA: | 3 |
HBD: | 3 |
Rotatable Bonds: | 4 |
TPSA: | 75.35 |
cLogP: | 3.05 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
Mcule: | MCULE-1588691522 |
MolPort: | MolPort-003-959-713 |
β-Aminonaphtalenes
MAR-TRE-e86a56b5-98
0.426
MAR-TRE-e86a56b5-99
0.424
MAR-TRE-e86a56b5-81
0.414
MAR-TRE-e86a56b5-25
0.400
MAR-TRE-e86a56b5-66
0.360
TRY-UNI-9f475305-11
0.341
TRY-UNI-9f475305-10
0.341
MAR-TRE-e86a56b5-47
0.333
MAR-TRE-f6f5f473-80
0.333
DAN-MCD-50d01569-1
0.323
CHA-KIN-bfe9b535-6
0.321
MAR-TRE-e86a56b5-31
0.320
MAR-TRE-e86a56b5-58
0.314
NIM-NMI-8bb27a2b-26
0.314
MAR-TRE-e86a56b5-55
0.312
CHA-KIN-bfe9b535-1
0.310
MAR-TRE-e86a56b5-62
0.306
MAR-TRE-e86a56b5-56
0.306
NIM-NMI-8bb27a2b-9
0.305
JUA-UNI-a9dfaed1-7
0.302
MAR-TRE-e86a56b5-63
0.300
MAR-TRE-fffca54f-96
0.300
MAR-TRE-e86a56b5-69
0.299
LON-WEI-af038623-8
0.297
MAR-TRE-2fd8122f-56
0.293
NIC-BIO-a68395b7-3
0.293
NIC-BIO-a68395b7-5
0.293
JUA-UNI-b93289a4-7
0.292
NIC-BIO-a68395b7-4
0.291
MAR-TRE-e86a56b5-11
0.289
MAR-TRE-e86a56b5-45
0.288
MAR-TRE-e86a56b5-50
0.287
ALV-UNI-7ff1a6f9-46
0.287
MAR-TRE-e86a56b5-84
0.287
MAR-TRE-2fd8122f-51
0.286
CHA-KIN-bfe9b535-8
0.284
AAR-POS-d2a4d1df-16
0.284
VOL-CHA-d666e5ae-5
0.284
ALV-UNI-7ff1a6f9-45
0.282
VOL-CHA-d666e5ae-2
0.282
NIC-BIO-a68395b7-2
0.282
MAR-TRE-85681e92-51
0.278
MAK-UNK-c44f4be0-10
0.277
MAR-TRE-e86a56b5-5
0.274
ALV-UNI-7ff1a6f9-47
0.273
CHA-KIN-bfe9b535-2
0.271
CHA-KIN-bfe9b535-9
0.270
NIC-BIO-a68395b7-1
0.270
MAR-TRE-85681e92-70
0.269
MAR-TRE-e86a56b5-46
0.268
MAK-UNK-c44f4be0-8
0.267
MAR-TRE-e86a56b5-73
0.265
VOL-CHA-d666e5ae-4
0.264
MAR-TRE-e86a56b5-67
0.263
CHA-KIN-45d1307a-1
0.262
MAR-TRE-ebcc4ad6-35
0.262
VOL-CHA-d666e5ae-1
0.261
MAR-TRE-9d18ae8c-20
0.260
MAK-UNK-c44f4be0-11
0.260
MAR-TRE-e86a56b5-39
0.260
NIM-UNI-bb9030bf-8
0.258
CHA-KIN-bfe9b535-5
0.257
MAR-TRE-4f39ef4a-52
0.256
MAK-UNK-7c9d1431-3
0.256
DRR-IMP-dff87f5e-2
0.256
SHA-THE-408e7524-15
0.253
MAK-UNK-c44f4be0-9
0.253
CHA-KIN-bfe9b535-7
0.252
CHA-KIN-bfe9b535-4
0.252
CHA-KIN-45d1307a-3
0.250
MAR-TRE-e86a56b5-79
0.250
CHA-KIN-bfe9b535-3
0.250
NIM-UNI-ed9fc491-1
0.247
MAR-TRE-e86a56b5-6
0.247
MAR-TRE-e86a56b5-15
0.247
MAR-TRE-e86a56b5-21
0.247
MAR-TRE-e86a56b5-71
0.247
UNK-UNK-2ede4078-37
0.245
KEI-TRE-d5e2018a-73
0.245
NIM-UNI-ed9fc491-2
0.245
MAR-TRE-e86a56b5-36
0.244
MAR-TRE-e86a56b5-37
0.244
MAR-TRE-e86a56b5-32
0.244
MAR-TRE-e86a56b5-88
0.243
NIM-UNI-ed9fc491-3
0.242
MAR-TRE-e86a56b5-97
0.242
MAR-TRE-9d18ae8c-60
0.242
MAR-TRE-9d18ae8c-28
0.241
MAR-TRE-4f39ef4a-40
0.241
NIM-UNI-ed9fc491-4
0.240
JUS-UNI-57125a42-1
0.240
MAR-TRE-e86a56b5-86
0.239
MAK-UNK-c44f4be0-3
0.238
MAR-TRE-e86a56b5-28
0.238
MAK-UNK-c44f4be0-7
0.238
MAR-TRE-e86a56b5-40
0.237
OLE-CAR-5b17bec5-6
0.237
MAR-UCB-195bc32d-14
0.237
MAR-TRE-9d18ae8c-14
0.236
VOL-CHA-d666e5ae-3
0.236