Molecular Properties | |
SMILES: | CN(C)CCc1c[nH]c2ccccc12 |
MW: | 188.274 |
Fraction sp3: | 0.33 |
HBA: | 1 |
HBD: | 1 |
Rotatable Bonds: | 3 |
TPSA: | 19.03 |
cLogP: | 2.272 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
Mcule: | MCULE-1451594833 |
Order Status | |
Ordered: | 2020-03-31 |
Synthesis Location: | enamine |
Shipped: | synthesis in progress |
AAR-POS-d2a4d1df-2
SAN-PRS-3c4a6997-2
0.527
MAR-UCB-195bc32d-19
0.491
JOH-MSK-a63bdd1d-9
0.491
ANT-OPE-47f3bb65-4
0.475
MAR-UCB-195bc32d-23
0.474
ANT-OPE-47f3bb65-2
0.452
ANT-OPE-47f3bb65-5
0.443
MAR-UCB-195bc32d-18
0.429
TOM-OIS-cbf37265-2
0.422
ANT-OPE-47f3bb65-1
0.422
LON-WEI-b8d98729-34
0.422
ANT-OPE-47f3bb65-3
0.422
ANT-OPE-ab37bd51-2
0.418
MAR-UCB-195bc32d-22
0.417
CUN-WAB-25b584ee-2
0.410
MAR-TRE-85681e92-33
0.406
MAT-POS-162a9720-8
0.403
MAR-TRE-fd17a9b8-35
0.403
AAR-UNI-c25c2f1e-73
0.387
RED-RED-10c9212c-42
0.387
MAR-UCB-195bc32d-9
0.385
MAR-TRE-85681e92-68
0.375
FEL-WAB-fb168420-3
0.375
MAR-TRE-4f39ef4a-5
0.370
RED-RED-10c9212c-33
0.367
MAR-TRE-fffca54f-95
0.365
MAR-TRE-85681e92-53
0.365
MAR-TRE-f5c2d31c-47
0.362
FEL-WAB-fb168420-2
0.359
MAR-TRE-fd17a9b8-10
0.359
NIC-BIO-3276ca7f-7
0.356
NIC-BIO-3276ca7f-2
0.351
CUN-WAB-25b584ee-1
0.347
ALP-POS-a3de0cb1-15
0.346
MAR-TRE-85681e92-69
0.346
LON-WEI-5e7d1b3e-20
0.341
LON-WEI-4d77710c-20
0.341
AAR-UNI-c25c2f1e-26
0.341
MAR-UCB-195bc32d-5
0.338
AAR-UNI-c25c2f1e-72
0.337
MAR-TRE-b77b7921-67
0.337
MAT-POS-ea426761-94
0.333
MAR-TRE-fd17a9b8-18
0.333
AAR-UNI-c25c2f1e-29
0.325
GAB-REV-df64cf17-18
0.325
MAR-TRE-4f781e27-69
0.325
MAR-TRE-4f39ef4a-9
0.321
MAR-TRE-4f781e27-6
0.321
BUT-SEX-9e782cc8-1
0.316
ANT-OPE-ab37bd51-1
0.314
MAR-TRE-74c6519b-79
0.312
DAR-DIA-eace69ff-35
0.311
ALP-POS-8ed8d9ec-2
0.310
SUN-WAB-e274cdaf-1
0.306
MAR-TRE-fd17a9b8-25
0.305
MAR-TRE-f6f5f473-6
0.301
WIL-UNI-1faa9b10-29
0.300
NJA-MAN-b9fb953f-5
0.297
ALP-POS-8ed8d9ec-6
0.295
YIA-UNI-71f25a82-2
0.293
YIA-UNI-71f25a82-1
0.292
MAR-TRE-36bf7dba-27
0.292
AAR-UNI-c25c2f1e-34
0.287
MAR-TRE-36bf7dba-26
0.287
JOH-MSK-a63bdd1d-7
0.286
SAL-INS-68b48d12-10
0.283
MAR-TRE-85681e92-10
0.276
MAR-TRE-36bf7dba-21
0.275
NIM-UNI-310206f0-49
0.274
SAL-INS-68b48d12-6
0.273
IAN-BAS-8ad3d156-1
0.272
BRU-UNI-248b30bc-12
0.269
MAR-TRE-85681e92-12
0.266
FAR-UNI-736b943a-8
0.265
AAR-POS-fca48359-10
0.265
JOH-MEM-4bb7e4cc-1
0.264
DUN-NEW-f8ce3686-12
0.264
MAT-GIT-deadff56-1
0.264
SAL-INS-68b48d12-9
0.263
SAL-INS-68b48d12-8
0.263
JOH-MSK-a63bdd1d-4
0.261
MAR-UCB-195bc32d-16
0.261
NIM-UNI-310206f0-31
0.260
SAN-PRS-3c4a6997-1
0.257
SAN-PRS-3c4a6997-4
0.257
AAR-POS-d2a4d1df-2
0.257
SAL-INS-68b48d12-7
0.255
ELE-IMP-dfb36048-5
0.254
NAU-LAT-81109c57-8
0.253
JIN-POS-6dc588a4-5
0.253
JOH-MSK-35a8745a-1
0.250
JOH-MSK-a63bdd1d-5
0.250
MAR-TRE-fd17a9b8-1
0.250
MAR-UCB-195bc32d-21
0.250
ALE-ACE-2610ee4d-1
0.250
MAR-UNI-9ca61fdc-1
0.250
SAL-INS-68b48d12-5
0.248
BRU-UNI-248b30bc-19
0.239
JOH-MEM-5e386bbd-7
0.238
RED-RED-10c9212c-9
0.237