Molecular Properties | |
SMILES: | O=C(c1ccc(-c2cncnc2)o1)N1CCOCC1 |
MW: | 259.1 |
Fraction sp3: | 0.31 |
HBA: | 5 |
HBD: | 0 |
Rotatable Bonds: | 2 |
TPSA: | 68.46 |
cLogP: | 1.21 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
Mcule: | MCULE-5615476370 |
MolPort: | MolPort-029-891-031 |
MAR-TRE-8190bb11-7
0.390
MAR-TRE-c317dd82-96
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MAR-TRE-be9ff7d2-16
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MAK-UNK-748f8b7a-11
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MAR-TRE-66ac689e-61
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MAR-TRE-c317dd82-13
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MAR-TRE-c317dd82-81
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MAR-TRE-c317dd82-73
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MAR-TRE-c317dd82-7
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MAR-TRE-a9136c7b-65
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MAR-TRE-c317dd82-69
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MAR-TRE-c317dd82-45
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MAR-TRE-e82e6c98-52
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MAR-TRE-c317dd82-23
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PAT-GYR-359dbb24-3
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MAR-TRE-c317dd82-27
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GIA-UNK-30c7cb75-2
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MAR-TRE-799db12b-34
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PET-SGC-cb83a00c-1
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MAR-TRE-a9136c7b-16
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PAT-GYR-359dbb24-1
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AAR-POS-d2a4d1df-21
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MAR-TRE-dab8f6ea-14
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MAR-TRE-a9136c7b-17
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MAR-TRE-8190bb11-100
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MAR-TRE-4f781e27-67
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MAR-TRE-c317dd82-18
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SAD-SAT-24589cd1-2
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MAR-TRE-799db12b-64
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PAT-GYR-359dbb24-2
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MAR-TRE-c317dd82-22
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PAT-GYR-de8eec61-4
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NIM-UNI-534877e5-2
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MAR-TRE-a9136c7b-11
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GIA-UNK-eaadd1d4-3
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PAT-GYR-359dbb24-4
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MAR-TRE-a9136c7b-38
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GIA-UNK-3f36037a-6
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SCO-CSI-e30c12ee-1
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GIA-UNK-30c7cb75-5
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MAR-TRE-a9136c7b-27
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GIA-UNK-3f36037a-2
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MAR-TRE-66ac689e-43
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NIM-UNI-310206f0-3
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MAK-UNK-f983951f-21
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MAR-TRE-dab8f6ea-25
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MAR-TRE-2fd8122f-35
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MAR-TRE-fd17a9b8-85
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MAR-TRE-dab8f6ea-13
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KEI-TRE-d5e2018a-36
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MAR-TRE-dab8f6ea-39
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SID-ELM-1f105489-13
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MAT-POS-b5746674-86
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PAT-GYR-de8eec61-7
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NIM-UNI-7f77122c-2
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MAR-TRE-4f781e27-88
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MAR-TRE-be9ff7d2-88
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MAR-TRE-d0525fbf-99
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PAT-GYR-de8eec61-2
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MAR-TRE-67513f76-51
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MAR-TRE-e82e6c98-10
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MAR-TRE-dab8f6ea-45
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MAR-TRE-799db12b-28
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WIL-LEE-1f71e281-1
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MAK-UNK-f983951f-6
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PET-SGC-276eba5a-1
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SAD-SAT-f25ee457-3
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ALP-POS-84f19ead-2
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MAK-UNK-748f8b7a-10
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MAR-TRE-799db12b-53
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MAR-TRE-92684b97-19
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MAR-TRE-c317dd82-86
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DAR-DIA-fb20be43-18
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MAR-TRE-a9136c7b-20
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MAR-TRE-66ac689e-88
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MAR-TRE-4f781e27-99
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MAR-TRE-9c797165-69
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MAR-TRE-e82e6c98-55
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MAR-TRE-799db12b-17
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ALP-POS-305f6ec3-26
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