Molecular Properties | |
SMILES: | CNC(=O)CN1Cc2ccc(Cl)cc2C(OC)(C(=O)Nc2cncc3ccccc23)C1 |
MW: | 438.15 |
Fraction sp3: | 0.26 |
HBA: | 5 |
HBD: | 2 |
Rotatable Bonds: | 5 |
TPSA: | 83.56 |
cLogP: | 2.93 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Order Status | |
Ordered: | 2021-08-07 |
Synthesis Location: | enamine |
Shipped: | synthesis in progress |
EDJ-MED-b1cef252-1
1.000
MAT-POS-89bd6af1-4
1.000
PET-UNK-9bf1291a-5
0.758
PET-UNK-9bf1291a-3
0.722
MAT-POS-89bd6af1-3
0.703
MAT-UNK-28cf4d29-1
0.703
ALP-POS-e266d783-2
0.703
PET-UNK-9bf1291a-1
0.699
MIC-UNK-ea4eb352-2
0.699
ALP-POS-5290f14d-1
0.699
EDJ-MED-cf877e1d-2
0.670
PET-UNK-88d26eaf-1
0.670
PET-UNK-757f8bc8-3
0.667
PET-UNK-9b23ef84-12
0.660
PET-UNK-757f8bc8-4
0.660
PET-UNK-9b23ef84-4
0.644
PET-UNK-9b23ef84-8
0.644
PET-UNK-757f8bc8-2
0.641
PET-UNK-757f8bc8-1
0.635
EDJ-MED-015fb6b4-1
0.634
MIC-UNK-54748b58-2
0.634
PET-UNK-6da3dcd8-8
0.629
MAT-POS-83a7b0a0-2
0.629
EDJ-MED-b1cef252-2
0.629
MAT-POS-89bd6af1-2
0.629
DAR-DIA-9f765dc6-13
0.618
DAR-DIA-9f765dc6-14
0.618
DAR-DIA-9f765dc6-15
0.618
PET-UNK-9bf1291a-4
0.614
PET-UNK-6da3dcd8-5
0.613
DAR-DIA-9f765dc6-16
0.608
DAR-DIA-9f765dc6-17
0.608
DAR-DIA-9f765dc6-18
0.608
MAR-UCB-6ab2ec87-3
0.606
PET-UNK-1b92fa34-5
0.598
PET-UNK-ad758083-1
0.592
EDJ-MED-e9a22d5d-2
0.590
PET-UNK-1abb40f2-2
0.586
PET-UNK-1abb40f2-4
0.586
PET-UNK-4d432d33-3
0.577
PET-UNK-4d432d33-7
0.577
PET-UNK-9b23ef84-1
0.574
PET-UNK-0d6841fa-1
0.571
PET-UNK-ad758083-2
0.570
PET-UNK-9bf1291a-2
0.570
PET-UNK-bcc8fd08-4
0.567
PET-UNK-5ad1c31a-4
0.566
PET-UNK-5ad1c31a-10
0.566
BEN-DND-a02b439d-12
0.566
PET-UNK-4d432d33-4
0.562
PET-UNK-4d432d33-8
0.562
MAT-POS-f9802937-1
0.560
PET-UNK-022eab87-2
0.557
EDJ-MED-d08626de-1
0.556
PET-UNK-29afea89-2
0.556
EDG-MED-0e5afe9d-3
0.556
EDJ-MED-d08626de-2
0.556
EDJ-MED-923a35c2-5
0.553
EDJ-MED-841e0cf0-3
0.553
EDJ-MED-670ad2ee-3
0.553
EDJ-MED-841e0cf0-2
0.552
EDJ-MED-670ad2ee-2
0.552
MIC-UNK-ea4eb352-10
0.552
PET-UNK-5ad1c31a-3
0.551
PET-UNK-5ad1c31a-9
0.551
MAT-POS-c7771779-2
0.550
MAT-POS-89e65850-2
0.550
MIC-UNK-ea4eb352-3
0.550
MAT-POS-d8472c4f-3
0.550
MAT-POS-89e65850-1
0.550
EDJ-MED-670ad2ee-1
0.549
EDJ-MED-841e0cf0-1
0.549
MIC-UNK-ea4eb352-6
0.549
PET-UNK-757f8bc8-7
0.547
PET-UNK-0d6841fa-2
0.545
MIC-UNK-ea4eb352-4
0.545
EDJ-MED-211392e3-1
0.545
MIC-UNK-ea4eb352-1
0.545
PET-UNK-c0891748-3
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PET-UNK-c0891748-5
0.545
PET-UNK-c0891748-9
0.545
PET-UNK-c0891748-11
0.545
PET-UNK-c65ea24c-13
0.543
PET-UNK-0d6841fa-7
0.543
FRA-DIA-6238d354-1
0.543
EDJ-MED-923a35c2-1
0.543
PET-UNK-f360ae44-6
0.541
PET-UNK-f360ae44-14
0.541
PET-UNK-03fd2068-9
0.538
MIC-UNK-e8d6fb58-2
0.538
PET-UNK-f360ae44-5
0.536
PET-UNK-f360ae44-13
0.536
PET-UNK-1abb40f2-3
0.535
PET-UNK-1abb40f2-1
0.535
PET-UNK-7955f415-1
0.533
PET-UNK-b566c0b0-8
0.533
PET-UNK-c65ea24c-1
0.533
PET-UNK-7955f415-3
0.533
ALP-POS-f1807566-3
0.529
PET-UNK-f4e47ebd-24
0.529