Molecular Properties | |
SMILES: | C=CC(=O)NCCNc1cc(F)cc2c(CCNC(C)=O)c[nH]c12 |
MW: | 332.16 |
Fraction sp3: | 0.29 |
HBA: | 3 |
HBD: | 4 |
Rotatable Bonds: | 8 |
TPSA: | 86.02 |
cLogP: | 1.7 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Order Status | |
Ordered: | 2020-06-15 |
Synthesis Location: | enamine |
Shipped: | synthesis in progress |
Aliphatic long chain
GAB-REV-4a4e2ff3-21
0.585
TAM-UNI-c140e31a-3
0.544
GAB-REV-4a4e2ff3-13
0.539
GAB-REV-4a4e2ff3-14
0.537
ANT-OPE-b90194ad-1
0.521
GAB-REV-4a4e2ff3-6
0.518
NAU-LAT-81109c57-3
0.506
GAB-REV-4a4e2ff3-16
0.505
GAB-REV-4a4e2ff3-20
0.505
ASH-UNK-40b46b30-7
0.500
MAK-UNK-be5ffcbc-9
0.494
NIR-THE-0d6461ce-3
0.484
GAB-REV-4a4e2ff3-18
0.479
MAK-UNK-ec98eaf6-34
0.474
JOK-SYG-b7365cd7-1
0.459
WIL-LEE-1f71e281-6
0.458
PET-SGC-f818f65b-1
0.452
ELE-IMP-dfb36048-1
0.452
SIM-DEM-265738e1-1
0.452
SAM-UNK-903735bd-2
0.452
TAM-UNI-c140e31a-15
0.452
GAB-REV-4a4e2ff3-11
0.449
MAK-UNK-be5ffcbc-6
0.437
MAK-UNK-be5ffcbc-5
0.435
MAK-UNK-be5ffcbc-2
0.432
GAB-REV-4a4e2ff3-12
0.427
MAK-UNK-be5ffcbc-4
0.427
TAM-UNI-c140e31a-2
0.424
SAM-UNK-903735bd-1
0.422
ASH-UNK-40b46b30-5
0.422
JOK-SYG-302da050-1
0.419
NAU-LAT-f723e322-1
0.419
STU-CHA-bc0a9883-1
0.419
DAR-DIA-fb20be43-11
0.419
NAU-LAT-f723e322-2
0.415
NAU-LAT-81109c57-5
0.413
AAR-POS-d2a4d1df-2
0.412
GAB-REV-4a4e2ff3-8
0.409
PET-SGC-1c3a473d-1
0.408
NAU-LAT-81109c57-6
0.404
GAB-REV-4a4e2ff3-3
0.402
GAB-REV-4a4e2ff3-15
0.402
NIR-THE-0d6461ce-2
0.396
GAB-REV-4a4e2ff3-5
0.394
GAB-REV-4a4e2ff3-4
0.392
WAR-XCH-e55cba98-2
0.388
MAK-UNK-ec98eaf6-33
0.388
NAU-LAT-81109c57-7
0.386
TAM-UNI-c140e31a-22
0.385
GAB-REV-4a4e2ff3-19
0.384
ROB-UNI-b2e39629-6
0.384
GAB-REV-4a4e2ff3-1
0.382
GAB-REV-4a4e2ff3-17
0.381
GAB-REV-4a4e2ff3-10
0.381
DAR-DIA-caba39e3-6
0.381
WAR-XCH-e55cba98-3
0.379
GAB-REV-4a4e2ff3-9
0.379
JAN-GHE-6413aaf8-5
0.375
ROB-UNI-b2e39629-7
0.371
JOK-SYG-b9f02a42-3
0.366
GAB-REV-4a4e2ff3-2
0.365
WAR-XCH-e55cba98-5
0.364
SAN-PRS-3c4a6997-1
0.361
HAN-NEW-5f56c3bc-2
0.360
GAB-REV-4a4e2ff3-7
0.358
JOK-SYG-b9f02a42-2
0.356
ROB-UNI-b2e39629-4
0.356
BEN-DND-362d364a-8
0.356
JOH-MSK-d60b0211-1
0.354
PAT-UNK-b2d83456-5
0.354
JOK-SYG-b9f02a42-1
0.350
DAR-DIA-fb20be43-14
0.350
MAR-UCB-195bc32d-16
0.349
JOH-MSK-a63bdd1d-4
0.349
CAL-AMP-9edebd8f-1
0.348
DUN-NEW-f8ce3686-10
0.348
ELE-IMP-dfb36048-2
0.348
DAR-DIA-fb20be43-15
0.347
PAT-UNK-b2d83456-4
0.340
MAK-UNK-10572812-12
0.339
ALE-ACE-2610ee4d-1
0.337
MAR-UCB-195bc32d-21
0.337
JOH-MSK-35a8745a-1
0.337
FRA-DIA-8640f307-1
0.333
DUN-NEW-f8ce3686-12
0.333
DUN-NEW-f8ce3686-21
0.333
JOH-MEM-4bb7e4cc-1
0.333
MAT-GIT-deadff56-1
0.333
SAN-PRS-3c4a6997-2
0.329
NAU-LAT-30527ac5-5
0.327
NAU-LAT-0543f7f2-3
0.327
NIR-THE-c331be7a-3
0.321
NAU-LAT-30527ac5-4
0.321
JOH-CHE-3504ac3d-2
0.320
DUN-NEW-f8ce3686-24
0.320
DUN-NEW-f8ce3686-11
0.320
JOH-MSK-a63bdd1d-5
0.319
JOH-MSK-a63bdd1d-1
0.318
JOH-MSK-a63bdd1d-2
0.312
WIL-LEE-364b6ea8-13
0.312