Molecular Properties | |
SMILES: | N=C(N=C(N)N)N1CCOCC1 |
MW: | 171.11 |
Fraction sp3: | 0.67 |
HBA: | 2 |
HBD: | 3 |
Rotatable Bonds: | 0 |
TPSA: | 100.72 |
cLogP: | -1.47 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
Enamine BB: | EN300-216965 |
Enamine SCR: | Z2160887313 |
Mcule: | MCULE-6852238035 |
MolPort: | MolPort-000-745-489 |
imine
imine
Imine 3
AAR-POS-d2a4d1df-1
MAK-UNK-f983951f-21
0.341
MAK-UNK-f983951f-6
0.295
GIA-UNK-3f36037a-1
0.278
MAK-UNK-be3f299e-5
0.255
PAT-GYR-359dbb24-4
0.250
JOH-UNI-27ac80fd-19
0.245
SAD-SAT-6b5a89f0-2
0.244
MAR-TRE-dab8f6ea-45
0.239
GIA-UNK-3f36037a-2
0.237
RAF-POL-b61b4b25-1
0.228
JOH-UNI-27ac80fd-17
0.228
GIA-UNK-3f36037a-6
0.226
PAT-GYR-359dbb24-1
0.226
AAR-POS-d2a4d1df-21
0.226
PAT-GYR-359dbb24-2
0.219
JOH-UNI-27ac80fd-2
0.217
JOH-UNI-27ac80fd-4
0.217
GIA-UNK-d2defdc3-6
0.215
MAR-TRE-dab8f6ea-31
0.213
MAR-TRE-dab8f6ea-47
0.213
PET-SGC-cb83a00c-1
0.212
JOH-UNI-27ac80fd-1
0.211
GIA-UNK-30c7cb75-2
0.210
GIA-UNK-30c7cb75-5
0.209
MAR-TRE-be9ff7d2-16
0.209
DAR-DIA-fb20be43-18
0.205
MAR-TRE-c317dd82-96
0.203
PAT-GYR-de8eec61-4
0.203
PAT-GYR-359dbb24-3
0.203
PAT-GYR-359dbb24-5
0.200
TAM-UNI-d1c3dd9f-21
0.200
MAR-LAB-ca4662a6-5
0.200
MAR-TRE-dab8f6ea-18
0.198
TAM-UNI-d1c3dd9f-12
0.197
MAR-TRE-dab8f6ea-13
0.197
GIA-UNK-eaadd1d4-3
0.197
MAR-TRE-dab8f6ea-29
0.197
JOH-UNI-27ac80fd-3
0.197
AAR-POS-0daf6b7e-29
0.196
JOH-IMS-1436231f-6
0.196
MAK-UNK-be3f299e-7
0.196
MAR-TRE-dab8f6ea-20
0.195
DAN-MCD-3ec20f87-1
0.195
GIA-UNK-d2defdc3-5
0.194
MAR-TRE-8190bb11-7
0.194
JOH-UNI-abdb2f0c-3
0.194
MAK-UNK-9955b1f3-14
0.193
MAR-TRE-f5c2d31c-64
0.192
JOH-IMS-0f19a540-4
0.191
JOH-IMS-7e73aedd-10
0.191
MAR-TRE-dab8f6ea-16
0.190
DAR-DIA-fb20be43-17
0.190
MAR-TRE-7f7bb9f0-29
0.190
MAK-UNK-748f8b7a-11
0.190
WIL-LEE-1f71e281-1
0.189
MAR-TRE-dab8f6ea-26
0.188
STU-CHA-6cae54d3-1
0.188
MAR-TRE-dab8f6ea-41
0.187
JOH-ILL-da934517-1
0.187
MAR-TRE-c317dd82-7
0.187
MAK-UNK-704ed37c-3
0.186
JOH-UNI-27ac80fd-22
0.186
WIL-LEE-23e8b574-8
0.186
MAR-TRE-7f7bb9f0-80
0.185
MAR-TRE-dab8f6ea-37
0.184
PAT-GYR-de8eec61-1
0.184
JOH-UNI-27ac80fd-20
0.183
MAR-TRE-dab8f6ea-30
0.183
SAD-SAT-f25ee457-2
0.183
MAR-TRE-d3c2bf0e-47
0.182
BEN-DND-93268d01-10
0.182
MAR-TRE-c317dd82-13
0.182
LUI-IND-a1be81af-2
0.182
MAK-UNK-9955b1f3-2
0.182
MAR-TRE-fd17a9b8-7
0.182
MAR-TRE-dab8f6ea-8
0.182
SAD-SAT-f25ee457-9
0.181
MAR-TRE-dab8f6ea-19
0.181
MAR-TRE-dab8f6ea-27
0.181
MAR-TRE-dab8f6ea-40
0.181
PAT-GYR-de8eec61-7
0.179
PAT-GYR-de8eec61-5
0.179
ANT-DIA-b7f58f21-9
0.179
JOH-UNI-27ac80fd-5
0.179
DAR-DIA-fb20be43-16
0.179
MAK-UNK-9955b1f3-3
0.179
TAM-UNI-d1c3dd9f-1
0.179
MAR-TRE-fffca54f-43
0.178
SAD-SAT-d8079f6f-5
0.178
PAT-GYR-de8eec61-2
0.177
NIM-UNI-310206f0-7
0.176
MAR-TRE-dab8f6ea-33
0.176
MAR-TRE-67513f76-86
0.176
MAR-TRE-66ac689e-61
0.176
DUN-NEW-f8ce3686-13
0.175
MAR-TRE-7f7bb9f0-65
0.175
MAR-TRE-6c5ef77a-21
0.175
AAR-POS-0daf6b7e-43
0.175
MAK-UNK-10799360-19
0.174
MAR-TRE-dab8f6ea-25
0.174