Molecular Properties | |
SMILES: | O=C(CNc1ccc(Cl)c(Br)c1)NCc1cccnc1 |
MW: | 354.635 |
Fraction sp3: | 0.14 |
HBA: | 3 |
HBD: | 2 |
Rotatable Bonds: | 5 |
TPSA: | 54.02 |
cLogP: | 3.2258 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Filter9_metal
aryl bromide
CHA-MCP-85291e1d-7
0.386
NAU-LAT-64f4b287-9
0.370
MAR-TRE-fd17a9b8-92
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AAR-UNI-c25c2f1e-9
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MAR-TRE-d0525fbf-91
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ANT-DIA-045cfdc4-5
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MAR-TRE-fd17a9b8-62
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MAR-TRE-04c86cea-80
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MAR-TRE-fd17a9b8-79
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AAR-UNI-c25c2f1e-102
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BEN-VAN-ed886787-13
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MAR-TRE-fd17a9b8-80
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MAR-TRE-fd17a9b8-69
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AAR-UNI-c25c2f1e-21
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MAR-TRE-4f781e27-34
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MAK-UNK-af83ef51-13
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BEN-VAN-ed886787-15
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MAR-TRE-87acfbcc-76
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MAR-TRE-fd17a9b8-44
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MAR-TRE-423310b6-46
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BEN-DND-61647d40-18
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DAR-DIA-23aa0b97-16
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MAK-UNK-a7b37c5e-1
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DAR-DIA-23aa0b97-6
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DAR-DIA-23aa0b97-4
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BEN-DND-61647d40-17
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WIL-UNI-1faa9b10-8
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EDG-MED-0da5ad92-2
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MAK-UNK-ca11b4f7-1
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LON-WEI-adc59df6-28
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DRR-IMP-38dce17f-4
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GAB-REV-70cc3ca5-13
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ALP-POS-88a7a97e-4
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MAK-UNK-10dfa458-35
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MAR-TRE-fd17a9b8-90
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BAR-COM-4e090d3a-69
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MAK-UNK-d1e89583-6
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MAR-TRE-2fd8122f-85
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MAR-TRE-6c5ef77a-45
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MAR-TRE-2fd8122f-60
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BEN-DND-61647d40-8
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SAD-SAT-24589cd1-4
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DAR-DIA-6a49afbe-9
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BEN-VAN-ed886787-1
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JOH-UNK-14e6adc5-5
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MAK-UNK-d1e89583-1
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MAK-UNK-a7b37c5e-4
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MAR-TRE-0fda4e82-32
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SER-UNI-985a0e14-1
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MAR-TRE-7f7bb9f0-74
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MAK-UNK-2c1752f0-1
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CHA-MCP-85291e1d-5
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MAK-UNK-d1e89583-5
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MAR-TRE-67513f76-93
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NIM-UNI-b87c0f72-2
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NIM-UNI-b87c0f72-1
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SAM-UNK-2684b532-11
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SAN-PRS-52b81272-2
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DAR-DIA-6a49afbe-7
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MAR-TRE-4f781e27-2
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MAR-TRE-74c6519b-68
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TRY-UNI-1fd04853-9
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ADA-UNI-f8e79267-11
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MAR-TRE-74c6519b-20
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MAK-UNK-c749d764-17
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MAR-TRE-67513f76-81
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MAK-UNK-d1e89583-3
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BEN-VAN-ed886787-3
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MAR-TRE-92684b97-81
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MAR-TRE-85681e92-61
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ALP-POS-95b75b4d-7
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BEN-VAN-c4cc60be-1
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MAR-TRE-c8530538-17
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SAD-SAT-135344c3-9
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MAR-TRE-d0525fbf-14
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KEI-TRE-d5e2018a-79
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BEN-DND-031a96cc-1
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MAK-UNK-d1e89583-9
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ANN-UNI-26382800-5
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DAR-DIA-23aa0b97-17
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CHR-SOS-59746812-2
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LON-WEI-120e5cf5-11
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DAR-DIA-6a49afbe-1
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ALP-POS-76eab5ce-2
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MAR-TRE-04c86cea-90
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MAR-TRE-c8530538-92
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DAR-DIA-23aa0b97-15
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MAR-TRE-e82e6c98-54
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ANT-DIA-3c79be55-2
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WAR-XCH-eb7b662f-5
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MAK-UNK-d1e89583-8
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CHR-SOS-59746812-6
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RAL-MED-2de63afb-12
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CHA-MCP-85291e1d-2
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MAR-TRE-3e4e6814-50
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WIL-UNI-5578df48-17
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AAR-UNI-c25c2f1e-8
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KEI-TRE-d5e2018a-54
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JOH-IMS-62aeb97d-5
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MAK-UNK-a7b37c5e-5
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