Molecular Properties | |
SMILES: | CCCc1n[nH]c(C2CN(C(=O)C3CC4CC3CN4C(=O)CCl)CCO2)n1 |
MW: | 395.17 |
Fraction sp3: | 0.78 |
HBA: | 5 |
HBD: | 1 |
Rotatable Bonds: | 5 |
TPSA: | 91.42 |
cLogP: | 1.13 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
MED-COV-4280ac29-15
LON-WEI-120e5cf5-8
0.620
MAK-UNK-3f402c2b-20
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MAK-UNK-3f402c2b-28
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MAK-UNK-3e0761f8-3
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MAK-UNK-3e0761f8-8
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MAK-UNK-3e0761f8-5
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MAK-UNK-5d2caa6f-1
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MAK-UNK-90d0606b-10
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MAK-UNK-90d0606b-2
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MAK-UNK-5d2caa6f-22
0.306
MAK-UNK-3e0761f8-1
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MAK-UNK-5d2caa6f-20
0.300
MAK-UNK-90d0606b-9
0.299
MAK-UNK-5d2caa6f-19
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MAK-UNK-5d2caa6f-16
0.297
MAK-UNK-3f402c2b-19
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MAK-UNK-90d0606b-8
0.287
MAK-UNK-5d2caa6f-21
0.286
MAK-UNK-5d2caa6f-17
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MAK-UNK-5d2caa6f-13
0.283
MAK-UNK-df1a028e-5
0.279
MAR-TRE-6a44bbf2-39
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AAR-POS-d2a4d1df-33
0.273
MAK-UNK-3e0761f8-6
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MAK-UNK-5d2caa6f-15
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MAK-UNK-ec98eaf6-43
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MAK-UNK-5d2caa6f-14
0.271
JOK-SYG-8934678c-1
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MAK-UNK-ec98eaf6-37
0.263
SAD-SAT-d8079f6f-2
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MAK-UNK-5d2caa6f-18
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MAK-UNK-ec98eaf6-38
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MAK-UNK-ec98eaf6-5
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MAK-UNK-ec98eaf6-34
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MAK-UNK-bae89c02-2
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MAK-UNK-ec98eaf6-36
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MAK-UNK-ec98eaf6-32
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MAK-UNK-3f402c2b-18
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MAK-UNK-3f402c2b-29
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MAK-UNK-ec98eaf6-48
0.235
NIM-UNI-43fe0159-12
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MAK-UNK-10799360-12
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MAK-UNK-10799360-7
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MAK-UNK-ec98eaf6-35
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FOC-CAS-e3a94da8-1
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MAR-TRE-dab8f6ea-28
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MAR-TRE-be9ff7d2-99
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MAK-UNK-10799360-19
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MAK-UNK-ec98eaf6-33
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MAK-UNK-5d2caa6f-11
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MAK-UNK-3f402c2b-27
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IND-SYN-6c8299e8-12
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NIM-UNI-43fe0159-9
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MAK-UNK-10799360-10
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MAK-UNK-10799360-34
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MAK-UNK-ec98eaf6-2
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MAK-UNK-ec98eaf6-23
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MAR-TRE-6a44bbf2-66
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MAK-UNK-750cfbcc-4
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MAK-UNK-10799360-11
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NIR-THE-0d6461ce-7
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NIM-UNI-43fe0159-11
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MAR-TRE-c317dd82-32
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SAD-SAT-1f400d17-3
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MAK-UNK-3f402c2b-7
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MAR-TRE-c317dd82-50
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MAK-UNK-3f402c2b-6
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MAR-TRE-dab8f6ea-49
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MAR-TRE-c317dd82-49
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MAK-UNK-90d0606b-6
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MAK-UNK-ec98eaf6-15
0.214
MAK-UNK-ec98eaf6-1
0.214
MAK-UNK-ec98eaf6-22
0.214
NIM-UNI-43fe0159-10
0.213
MAK-UNK-df1a028e-7
0.213
BOG-INS-d6bb07dc-1
0.213
NIM-UNI-363644a0-1
0.212
MAK-UNK-ec98eaf6-11
0.212
MAR-TRE-dab8f6ea-15
0.212
BOG-INS-177e97e6-1
0.212
MAK-UNK-df1a028e-9
0.212
SAD-SAT-3a925b8b-7
0.212
MAK-UNK-10799360-36
0.211
SAD-SAT-2ceae68f-10
0.211
MAK-UNK-10799360-1
0.211
MAK-UNK-5d2caa6f-5
0.211
MAK-UNK-af83ef51-30
0.210
NIM-UNI-43fe0159-7
0.210
MAK-UNK-5d2caa6f-23
0.209
MAK-UNK-df1a028e-4
0.209
MAK-UNK-3f402c2b-12
0.209
MAK-UNK-ec98eaf6-9
0.209
NIR-THE-0d6461ce-6
0.209
WAR-XCH-b0339bbe-3
0.209
MAK-UNK-10799360-17
0.208
FOC-CAS-e3a94da8-2
0.208
NIM-UNI-43fe0159-3
0.208
MAK-UNK-d4768348-4
0.208
BOG-INS-da52c1c2-1
0.208
MAK-UNK-3f402c2b-5
0.208