Molecular Properties | |
SMILES: | O=C(Nc1cc[nH]c1)Nc1cccc(F)c1 |
MW: | 219.219 |
Fraction sp3: | 0.0 |
HBA: | 1 |
HBD: | 3 |
Rotatable Bonds: | 2 |
TPSA: | 56.92 |
cLogP: | 2.7978 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
AAR-POS-d2a4d1df-2
CAS-DEP-751a2458-4
0.538
WIL-UNI-1faa9b10-12
0.362
WIL-UNI-1faa9b10-23
0.338
MAR-TRE-0fda4e82-47
0.338
MAR-TRE-f5c2d31c-6
0.338
MAR-TRE-6c5ef77a-47
0.338
MAR-TRE-6a44bbf2-3
0.329
MAR-TRE-f5c2d31c-20
0.322
CAS-DEP-167c18e3-4
0.315
WIL-UNI-1faa9b10-11
0.308
MAK-UNK-0cb6a3ad-11
0.306
DAR-DIA-23aa0b97-8
0.306
DAR-DIA-23aa0b97-13
0.304
MAR-TRE-6c5ef77a-17
0.302
ANN-UNI-26382800-6
0.300
ANN-UNI-26382800-4
0.300
JOR-UNI-61e7b1d5-2
0.300
WAR-XCH-eb7b662f-1
0.300
DAR-DIA-23aa0b97-5
0.300
WAR-XCH-eb7b662f-7
0.299
JOR-UNI-2fc98d0b-7
0.299
DAR-DIA-23aa0b97-14
0.299
JAN-GHE-83b26c96-19
0.299
WAR-XCH-eb7b662f-6
0.299
ABB-MCD-f549d731-1
0.289
WIL-UNI-5578df48-21
0.286
BRU-UNI-248b30bc-6
0.284
LON-WEI-b2874fec-24
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WIL-UNI-1faa9b10-31
0.280
DAR-DIA-23aa0b97-11
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LON-WEI-5e7d1b3e-23
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LON-WEI-4d77710c-23
0.280
LON-WEI-5e7d1b3e-6
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LON-WEI-4d77710c-6
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MAK-UNK-37f1d6fa-6
0.278
MAK-UNK-009ebe36-2
0.277
AAR-UNI-c25c2f1e-31
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WIL-UNI-5578df48-19
0.276
MAR-TRE-9d18ae8c-10
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BAR-COM-21d20d65-7
0.274
MAK-UNK-129dcd6f-2
0.272
WIL-UNI-5578df48-22
0.270
MAR-TRE-d0525fbf-48
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SID-ELM-2583a2cd-6
0.269
AAR-UNI-c25c2f1e-40
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JAN-LUN-8953ce76-7
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JAN-LUN-8953ce76-1
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JAN-LUN-3e0f9c09-4
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WIL-UNI-5578df48-23
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BAR-COM-21d20d65-3
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WIL-UNI-1faa9b10-46
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AAR-UNI-c25c2f1e-65
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MAR-TRE-3e4e6814-15
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JAN-LUN-8953ce76-4
0.263
JAN-LUN-3e0f9c09-2
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JAN-LUN-3e0f9c09-1
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JAN-LUN-8953ce76-6
0.263
CAS-DEP-751a2458-5
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MAR-TRE-74c6519b-84
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TRY-UNI-714a760b-24
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WIL-UNI-1faa9b10-36
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LON-WEI-adc59df6-46
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MAR-TRE-3e4e6814-91
0.258
MAK-UNK-c8c8f7e2-14
0.257
MAK-UNK-7a704a63-2
0.257
JAG-UCB-cedd89ab-8
0.257
TRY-UNI-714a760b-12
0.257
AAR-UNI-c25c2f1e-39
0.256
BAR-COM-21d20d65-4
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BAR-COM-21d20d65-9
0.256
MAR-TRE-9d18ae8c-52
0.256
WIL-UNI-1faa9b10-47
0.256
SAD-SAT-135344c3-7
0.256
MAR-LAB-ca4662a6-4
0.254
SID-ELM-2583a2cd-5
0.254
CAS-DEP-751a2458-6
0.254
WIL-UNI-5578df48-28
0.253
BAR-COM-21d20d65-5
0.253
WIL-UNI-5578df48-29
0.253
MAR-TRE-92684b97-91
0.250
MAR-TRE-9d18ae8c-43
0.250
JAG-UCB-cedd89ab-7
0.250
DAR-DIA-0cde14eb-5
0.250
MAK-UNK-10dfa458-24
0.250
WIL-UNI-5578df48-26
0.250
CHR-SOS-363cfb78-1
0.250
TRY-UNI-714a760b-23
0.250
MAK-UNK-30aad1f1-8
0.250
MAK-UNK-37f1d6fa-3
0.250
MAR-TRE-74c6519b-64
0.247
MAK-UNK-37f1d6fa-2
0.247
BAR-COM-21d20d65-2
0.247
DAR-DIA-0cde14eb-50
0.247
WIL-UNI-5578df48-20
0.247
DAR-DIA-0cde14eb-7
0.247
JAG-UCB-cedd89ab-6
0.247
KEI-TRE-d5e2018a-25
0.247
WIL-UNI-1faa9b10-9
0.247
TRY-UNI-714a760b-9
0.247
MIC-UNK-66895286-2
0.247