Molecular Properties | |
SMILES: | Cc1cccc(N2CCN(C(=O)c3cc4c([nH]c3=O)CCC4)CC2)c1 |
MW: | 337.18 |
Fraction sp3: | 0.4 |
HBA: | 3 |
HBD: | 1 |
Rotatable Bonds: | 2 |
TPSA: | 56.41 |
cLogP: | 2.13 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Order Status | |
Shipped: | 2021-05-26 |
UNK-UNK-2ede4078-86
0.442
AHN-SAT-02ef6d10-3
0.438
UNK-UNK-2ede4078-79
0.433
SAD-SAT-5b1897b2-4
0.432
MAT-POS-450cb4f9-2
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UNK-UNK-2ede4078-15
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UNK-UNK-2ede4078-45
0.416
ERI-UCB-a0b0dbcb-3
0.368
ERI-UCB-a0b0dbcb-2
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ERI-UCB-a0b0dbcb-4
0.365
BEN-DND-7e92b6ca-15
0.362
BEN-DND-7e92b6ca-12
0.354
MAR-UCB-f313ec4d-5
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UNK-UNK-2ede4078-93
0.341
UNK-UNK-2ede4078-76
0.337
UNK-UNK-2ede4078-99
0.333
MAT-POS-3b536971-2
0.333
EDJ-MED-78f964c8-1
0.330
MAT-POS-916a2c5a-4
0.330
ERI-UCB-ce40166b-21
0.324
MAT-POS-8fd29122-2
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UNK-UNK-2ede4078-24
0.316
MAT-POS-54c4bf04-3
0.316
PET-UNK-82544c07-1
0.311
BEN-DND-7e92b6ca-14
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BEN-DND-7e92b6ca-11
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KRI-MAR-d2e3ef86-13
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KRI-MAR-d2e3ef86-7
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MAT-POS-590ac91e-63
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UNK-UNK-2ede4078-96
0.283
SAD-SAT-65574d3f-9
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BEN-DND-7e92b6ca-13
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UNK-UNK-2ede4078-69
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MAT-POS-162a9720-2
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NIL-NON-a189c016-1
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UNK-UNK-2ede4078-92
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MAR-UCB-f313ec4d-6
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BEN-DND-7e92b6ca-16
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EDJ-MED-d1cd9639-1
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MAR-TRE-a9136c7b-76
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MAT-POS-590ac91e-57
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UNK-UNK-2ede4078-75
0.257
PAT-UNK-b2d83456-3
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EDJ-MED-d1cd9639-2
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DAR-DIA-1a77c53a-1
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MAT-POS-590ac91e-64
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MAT-POS-590ac91e-65
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MAT-POS-590ac91e-66
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WIL-LEE-23e8b574-8
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MAT-POS-ea426761-41
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UNK-UNK-2ede4078-85
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BEN-DND-7e92b6ca-6
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KOV-VNK-5e1a909f-50
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MAT-POS-450cb4f9-1
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KRI-MAR-d2e3ef86-5
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BEN-DND-7e92b6ca-10
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MAT-POS-590ac91e-60
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ERI-UCB-a0b0dbcb-13
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JAR-KUA-8c13982c-10
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KRI-MAR-d2e3ef86-3
0.236
MAT-POS-916a2c5a-3
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UNK-UNK-2ede4078-74
0.236
KRI-MAR-d2e3ef86-4
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BEN-DND-7e92b6ca-7
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MAT-POS-590ac91e-61
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SAD-SAT-24589cd1-2
0.234
ERI-UCB-a0b0dbcb-14
0.234
MIH-UNI-e573136b-6
0.233
MAK-UNK-de8f6d00-2
0.233
MAR-TRE-d0525fbf-84
0.231
MAT-POS-590ac91e-69
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ERI-UCB-a0b0dbcb-1
0.229
NAU-LAT-56d5284e-5
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AAR-POS-d2a4d1df-24
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ERI-UCB-a0b0dbcb-11
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MAT-POS-590ac91e-58
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SAD-SAT-135344c3-8
0.226
MAR-TRE-c8530538-39
0.225
MAK-UNK-7a704a63-11
0.225
MAK-UNK-c8c8f7e2-2
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MAK-UNK-c8c8f7e2-4
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MAT-POS-590ac91e-56
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ERI-UCB-a0b0dbcb-12
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JAN-GHE-82a280f8-1
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KRI-MAR-d2e3ef86-6
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WAL-WAB-df110a02-2
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MAK-UNK-10dfa458-10
0.220
BAR-COM-4e090d3a-24
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NAU-LAT-56d5284e-1
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JON-UNI-bb9dc649-16
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MAT-POS-54c4bf04-4
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UNK-UNK-2ede4078-53
0.218
NAU-LAT-56d5284e-2
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MED-COV-4280ac29-7
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MAT-POS-590ac91e-59
0.216
MAK-UNK-6435e6c2-4
0.216
LAV-MCD-880a620a-1
0.216
NIR-THE-0d6461ce-1
0.215
MAR-TRE-8190bb11-27
0.215
ALP-POS-3fc1724e-3
0.215