Molecule Details
| Molecular Properties | |
| SMILES: | Cc1ccncc1NC(=O)N1CC2(CCNCC2)c2ccc(Br)cc21 |
| MW: | 400.09 |
| Fraction sp3: | 0.37 |
| HBA: | 3 |
| HBD: | 2 |
| Rotatable Bonds: | 1 |
| TPSA: | 57.26 |
| cLogP: | 3.83 |
| Covalent Warhead: | ✗ |
| Covalent Fragment: | ✗ |
Filter9_metal
aryl bromide
SHA-LIV-041af2c0-2
0.640
MAR-UNK-3cb74d1d-1
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SHA-LIV-041af2c0-3
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SHA-LIV-041af2c0-4
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MAR-TRE-67513f76-79
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SCO-VAN-260d9628-1
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ALE-HEI-f28a35b5-17
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MAK-UNK-7264f48c-5
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JAN-GHE-83b26c96-12
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MAT-POS-e501d84c-1
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MAT-POS-590ac91e-24
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BEN-DND-6de5dfa0-4
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BEN-DND-09b88bf4-4
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AAR-POS-d2a4d1df-3
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MAK-UNK-6435e6c2-8
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DAR-DIA-0cde14eb-63
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BAR-COM-0f94fc3d-58
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CHR-SOS-1f323c23-11
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MAT-POS-590ac91e-22
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DAR-DIA-0cde14eb-65
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DAR-DIA-0cde14eb-68
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CHR-SOS-1f323c23-8
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DAR-DIA-0cde14eb-66
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EDG-MED-0da5ad92-9
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DAR-DIA-0cde14eb-67
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CHR-SOS-1f323c23-5
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CHR-SOS-6c45c019-6
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DAR-DIA-0cde14eb-61
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DAR-DIA-0cde14eb-64
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CHR-SOS-6c45c019-12
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MAT-POS-590ac91e-6
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DAR-DIA-0cde14eb-62
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DAR-DIA-0cde14eb-69
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TRY-UNI-2eddb1ff-1
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MAT-POS-590ac91e-7
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MAT-POS-590ac91e-9
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ALE-HEI-f28a35b5-12
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CHR-SOS-1f323c23-2
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CHR-SOS-6c45c019-9
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BEN-DND-93268d01-11
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MAT-POS-590ac91e-23
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ASH-SAT-43770c7d-9
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MAK-UNK-6ca90168-27
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DAR-DIA-0cde14eb-5
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EDJ-MED-e58735b6-3
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MAT-POS-590ac91e-29
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JAN-GHE-83b26c96-11
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DAR-DIA-23e5a6a0-30
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MAK-UNK-6ca90168-26
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DAR-DIA-0cde14eb-74
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ANN-UNI-98d2bf15-5
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DAR-DIA-0cde14eb-1
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DAR-DIA-0cde14eb-8
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EDJ-MED-3c65e9ce-1
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MAT-POS-590ac91e-15
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EDG-MED-0da5ad92-8
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TRY-UNI-2eddb1ff-2
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MAT-POS-590ac91e-21
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BEN-DND-93268d01-8
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MAT-POS-590ac91e-19
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ERI-UCB-5b47150d-4
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CHR-SOS-6c45c019-5
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CHR-SOS-6c45c019-11
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DAR-DIA-0cde14eb-2
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ASH-UNK-40b46b30-11
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MAT-POS-6c3d76b3-1
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MAT-POS-0d6fb2dd-1
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CHR-SOS-1f323c23-10
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DAR-DIA-23e5a6a0-24
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NAU-LAT-3f5f3993-2
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BEN-DND-93268d01-5
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EDJ-MED-e58735b6-2
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DAR-DIA-0cde14eb-20
0.311
MAT-POS-590ac91e-5
0.311
CHR-SOS-6c45c019-3
0.311
MAT-POS-590ac91e-11
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ALE-HEI-f28a35b5-13
0.310
DAR-DIA-0cde14eb-3
0.310
DAR-DIA-0cde14eb-4
0.310
VLA-UCB-00f2c2b3-1
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BAR-COM-0f94fc3d-19
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BEN-DND-93268d01-6
0.309
JAN-GHE-83b26c96-20
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EDG-MED-0da5ad92-11
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MAT-POS-590ac91e-27
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TRY-UNI-2eddb1ff-3
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ALP-POS-95b75b4d-1
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DAR-DIA-23e5a6a0-29
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MAT-POS-590ac91e-12
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BEN-DND-93268d01-9
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BEN-DND-09b88bf4-5
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GAB-REV-70cc3ca5-21
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TRY-UNI-714a760b-10
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EDG-MED-0da5ad92-4
0.308
ALE-HEI-f28a35b5-6
0.308
CHR-SOS-6c45c019-8
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CHR-SOS-1f323c23-7
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BEN-DND-6de5dfa0-6
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MAT-POS-590ac91e-2
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MAT-POS-590ac91e-1
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