Molecular Properties | |
SMILES: | Cn1ccc(CN2Cc3ccc(Cl)cc3[C@H](C(=O)Nc3cncc4ccc(F)cc34)C2)n1 |
MW: | 449.14 |
Fraction sp3: | 0.21 |
HBA: | 5 |
HBD: | 1 |
Rotatable Bonds: | 4 |
TPSA: | 63.05 |
cLogP: | 4.5 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Order Status | |
Ordered: | 2021-03-30 |
Synthesis Location: | enamine |
Shipped: | synthesis in progress |
MAT-POS-dd3ad2b5-4
MAT-POS-24589f88-16
1.000
EDJ-MED-009f762b-3
0.792
MAT-POS-61f37a1a-5
0.792
EDJ-MED-009f762b-2
0.775
MAT-POS-24589f88-5
0.775
MAT-POS-61f37a1a-13
0.772
EDJ-MED-009f762b-4
0.772
PET-UNK-162c14b2-2
0.724
EDJ-MED-009f762b-5
0.696
PET-UNK-03fd2068-3
0.644
EDJ-MED-841e0cf0-5
0.625
EDJ-MED-841e0cf0-7
0.625
EDJ-MED-670ad2ee-9
0.625
EDJ-MED-670ad2ee-10
0.625
EDJ-MED-670ad2ee-5
0.625
EDJ-MED-670ad2ee-6
0.625
EDJ-MED-670ad2ee-7
0.619
EDJ-MED-670ad2ee-8
0.619
EDJ-MED-841e0cf0-6
0.619
MAT-POS-81ae2990-3
0.589
ALF-EVA-0e90125c-9
0.586
MAT-POS-b4d6b7fc-9
0.584
MAT-POS-81ae2990-9
0.584
MAT-POS-81ae2990-6
0.574
PET-UNK-5ba9a1cb-2
0.571
PET-UNK-5ba9a1cb-3
0.571
PET-UNK-5ba9a1cb-1
0.566
EDJ-MED-fa7708b3-3
0.561
MIC-UNK-482af05e-2
0.556
MAT-POS-61f37a1a-12
0.551
PET-UNK-162c14b2-1
0.551
MIC-UNK-482af05e-1
0.545
MAT-POS-4223bc15-23
0.541
MAT-POS-4223bc15-26
0.541
MAT-POS-8293a91a-4
0.541
RAL-THA-ee48ba5f-5
0.541
MAT-POS-4223bc15-27
0.541
MAT-POS-8293a91a-5
0.541
MAT-POS-4223bc15-28
0.541
ALP-POS-6f6ae286-5
0.540
EDJ-MED-7889e8da-1
0.540
BEN-DND-f06bfa8e-2
0.540
EDJ-MED-0186a59b-1
0.540
EDJ-MED-fa7708b3-2
0.539
MAT-POS-97ec4bd1-3
0.539
EDJ-MED-c40d95bc-2
0.537
MAT-POS-4223bc15-25
0.537
MAT-POS-4223bc15-21
0.537
EDJ-MED-fa7708b3-1
0.536
RAL-THA-ee48ba5f-1
0.536
EDJ-MED-e9a22d5d-1
0.532
MAT-POS-4223bc15-24
0.532
MAT-POS-4223bc15-22
0.532
MAT-POS-2e8b2191-10
0.530
EDJ-MED-ede277f6-4
0.530
MAT-POS-5cd9ea36-15
0.526
XIA-UNK-50bd045a-1
0.526
PET-UNK-1b92fa34-2
0.523
RAL-THA-ee48ba5f-4
0.523
MAT-UNK-35705829-1
0.522
CLI-TLC-36f34aa2-1
0.522
EDJ-MED-ede277f6-7
0.521
RAL-THA-ee48ba5f-2
0.518
MAT-UNK-f490e871-1
0.518
MAT-POS-5cd9ea36-13
0.518
JOH-UNI-ededfdb6-1
0.518
MAT-UNK-04ae9652-1
0.518
EDJ-MED-c82a5324-3
0.517
BEN-DND-f2e727cd-6
0.514
MAT-POS-dd3ad2b5-1
0.514
MAT-POS-e119ab4f-2
0.509
MAT-POS-c7726e07-4
0.509
MAT-POS-c7726e07-3
0.509
RAL-THA-ee48ba5f-6
0.509
FRA-DIA-6238d354-2
0.505
NIR-WEI-dcc3321b-6
0.500
MAT-POS-4223bc15-34
0.500
PET-UNK-03fd2068-4
0.500
EDJ-MED-c40d95bc-1
0.500
PET-UNK-c6bcc80b-9
0.500
PET-UNK-c6bcc80b-2
0.500
RAL-THA-ee48ba5f-3
0.496
MAT-POS-4223bc15-41
0.496
MAT-POS-64942dd0-2
0.496
PET-UNK-03fd2068-5
0.496
EDJ-MED-7889e8da-3
0.496
EDJ-MED-0186a59b-2
0.496
MAT-POS-4223bc15-18
0.495
EDJ-MED-c82a5324-2
0.492
EDJ-MED-1b5395f9-4
0.491
EDJ-MED-1b5395f9-6
0.491
EDJ-MED-1b5395f9-5
0.491
MAT-POS-4223bc15-6
0.491
MAT-POS-dd3ad2b5-4
0.491
MAT-POS-24589f88-2
0.491
RAL-THA-6e4c80cf-1
0.491
MAT-POS-4223bc15-19
0.491
MAT-POS-24589f88-3
0.491
MAT-POS-dd3ad2b5-2
0.491
PET-UNK-9b23ef84-2
0.491