Molecular Properties | |
SMILES: | Cc1nc2c(c(=O)[nH]1)CCN(CC(=O)Nc1ccc(Cl)cn1)CC2 |
MW: | 347.11 |
Fraction sp3: | 0.38 |
HBA: | 5 |
HBD: | 2 |
Rotatable Bonds: | 3 |
TPSA: | 90.98 |
cLogP: | 1.17 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
Mcule: | MCULE-6234605793 |
MolPort: | MolPort-039-044-327 |
MAR-TRE-c8530538-81
0.423
MAR-TRE-c8530538-3
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MAR-TRE-c8530538-19
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MAR-TRE-c8530538-100
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MAR-TRE-c8530538-93
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MAR-TRE-c8530538-6
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MAR-TRE-c8530538-64
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MAR-TRE-c8530538-1
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BEN-DND-6de5dfa0-19
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MAR-TRE-c8530538-40
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BEN-DND-93268d01-10
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ANU-UNK-2781581f-1
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RED-SAT-26a928c9-1
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EDJ-MED-3c65e9ce-1
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BEN-DND-93268d01-8
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MAR-TRE-c8530538-98
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MAT-POS-ea426761-44
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BEN-DND-09b88bf4-5
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BEN-DND-93268d01-11
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BEN-DND-93268d01-9
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BEN-DND-6de5dfa0-24
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BEN-DND-6de5dfa0-4
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BEN-DND-09b88bf4-4
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NIR-THE-b7e8e081-2
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BEN-DND-6de5dfa0-16
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EDJ-MED-3c65e9ce-4
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VLA-UCB-05e51b3f-1
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ALP-POS-6747fa38-1
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NAU-LAT-a5c7d7cb-1
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BEN-DND-6de5dfa0-11
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NIR-THE-d08c3b48-1
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BEN-DND-6de5dfa0-2
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BEN-DND-09b88bf4-1
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BEN-DND-6de5dfa0-23
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BEN-DND-6de5dfa0-6
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NAU-LAT-3f5f3993-5
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BEN-DND-09b88bf4-3
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BEN-DND-6de5dfa0-3
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BEN-DND-6de5dfa0-22
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BEN-DND-03406596-7
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BEN-DND-09b88bf4-2
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BEN-DND-6de5dfa0-1
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BEN-DND-6de5dfa0-20
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NIR-THE-b7e8e081-1
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BEN-DND-6de5dfa0-21
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EDJ-MED-3c65e9ce-3
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BEN-DND-6de5dfa0-7
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BEN-DND-09b88bf4-6
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EDJ-MED-3c65e9ce-2
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BEN-DND-6de5dfa0-14
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BEN-DND-6de5dfa0-8
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BEN-DND-6de5dfa0-15
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MAR-TRE-6a44bbf2-12
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BEN-DND-09b88bf4-8
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BEN-DND-6de5dfa0-5
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MAR-TRE-c8530538-5
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MAR-TRE-fd17a9b8-98
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PET-UNK-7955f415-3
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PET-UNK-7955f415-1
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MAT-POS-a54ce14d-2
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MAT-POS-acfe5bae-2
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MAT-POS-a54ce14d-3
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EDJ-MED-015fb6b4-2
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BAR-COM-0f94fc3d-41
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BEN-DND-6de5dfa0-18
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EDJ-MED-2791eece-12
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MAT-POS-044491d2-5
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PET-UNK-f860268d-5
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PET-UNK-f860268d-2
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LON-WEI-1908424e-2
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VLA-UCB-05e51b3f-7
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VLA-UCB-50c39ae8-4
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RAL-THA-2d450e86-33
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PET-UNK-eeb64427-2
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EDJ-MED-c99b2211-1
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EDJ-MED-705e09b8-1
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MIK-UNK-1619f2e2-1
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MIK-UNK-122557fa-1
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PET-UNK-eeb64427-5
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RAL-THA-a9c31980-2
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MAR-TRE-67513f76-4
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RAL-THA-4aa06b95-3
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EDJ-MED-036ae2e9-2
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COM-UCB-8c7d23dc-16
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WIL-LEE-23e8b574-6
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BEN-DND-09b88bf4-7
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MAR-TRE-c8530538-57
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PET-UNK-eeb64427-3
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PET-UNK-eeb64427-6
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MAR-TRE-3e4e6814-55
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BEN-DND-22e6b372-4
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DAR-DIA-0d514e7d-34
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MAR-TRE-3e4e6814-16
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DAR-DIA-0d514e7d-35
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MIK-ENA-610c7cf9-1
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MAT-POS-b4d6b7fc-5
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LUO-POS-b4dec3be-1
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MIK-ENA-4bb8c98f-1
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LUO-POS-b4dec3be-2
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MAR-TRE-6c5ef77a-96
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