Molecular Properties | |
SMILES: | Cc1ccncc1NC(=O)Cc1ccc(S(N)(=O)=O)cc1 |
MW: | 305.359 |
Fraction sp3: | 0.14 |
HBA: | 4 |
HBD: | 2 |
Rotatable Bonds: | 4 |
TPSA: | 102.15 |
cLogP: | 1.21862 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
Enamine REAL: | Z1135790839 |
Enamine Extended REAL: | s_22____3391102____3173318 |
MolPort: | MolPort-047-314-982 |
Order Status | |
Ordered: | 2020-03-31 |
Synthesis Location: | enamine |
Shipped: | 2020-04-17 |
MAK-UNK-6435e6c2-8
JAN-GHE-83b26c96-11
0.714
TRY-UNI-714a760b-5
0.655
EDJ-MED-e58735b6-3
0.636
RAL-THA-6b94ceba-13
0.618
GAB-REV-70cc3ca5-3
0.612
PED-UNI-292b67d6-1
0.603
PET-SGC-83d43576-1
0.548
MIH-UNI-6b9ca91a-1
0.547
RAL-THA-6b94ceba-15
0.542
TRY-UNI-2eddb1ff-2
0.530
EDG-MED-0da5ad92-8
0.530
WIL-MOD-03b86a88-6
0.527
NAU-LAT-0543f7f2-7
0.527
TRY-UNI-714a760b-6
0.522
JAN-GHE-83b26c96-13
0.522
ALP-POS-95b75b4d-2
0.522
EDJ-MED-e58735b6-2
0.522
NAU-LAT-0543f7f2-6
0.520
MAK-UNK-6ca90168-26
0.517
ASH-SAT-43770c7d-9
0.517
JAN-GHE-83b26c96-12
0.515
ALP-POS-95b75b4d-1
0.515
ANN-UNI-98d2bf15-2
0.514
RAL-THA-6b94ceba-14
0.514
PET-SGC-d0fd10df-1
0.513
ANN-UNI-98d2bf15-1
0.507
JOH-UNI-abfda500-6
0.507
ALE-HEI-f28a35b5-3
0.500
NAU-LAT-0543f7f2-5
0.500
RAL-THA-6b94ceba-6
0.500
DAR-DIA-0cde14eb-78
0.500
EDJ-MED-e58735b6-1
0.500
GAB-REV-70cc3ca5-18
0.493
WIL-MOD-03b86a88-5
0.493
RAL-THA-6b94ceba-16
0.493
RAL-THA-6b94ceba-12
0.493
DAR-DIA-0cde14eb-64
0.493
ALP-POS-95b75b4d-4
0.493
ALP-POS-95b75b4d-3
0.493
JAN-GHE-83b26c96-14
0.493
DAR-DIA-0cde14eb-76
0.493
TRY-UNI-2eddb1ff-1
0.493
EDJ-MED-c9f55a56-1
0.493
PET-SGC-6e7c5dc0-1
0.492
ALE-HEI-f28a35b5-12
0.492
NAU-LAT-0543f7f2-8
0.487
VLA-UCB-00f2c2b3-2
0.486
TRY-UNI-714a760b-20
0.486
VLA-UCB-00f2c2b3-1
0.480
DAR-DIA-0cde14eb-79
0.479
MAT-POS-c9973a83-1
0.479
BEN-DND-93268d01-5
0.478
WIL-MOD-03b86a88-3
0.474
DAR-DIA-0cde14eb-1
0.473
DAR-DIA-0cde14eb-61
0.473
ANN-UNI-98d2bf15-5
0.473
MAK-UNK-372b0df5-3
0.471
ALE-HEI-f28a35b5-10
0.471
MAT-POS-590ac91e-6
0.470
MIH-UNI-6b9ca91a-3
0.469
MAT-POS-590ac91e-11
0.469
CHR-SOS-1f323c23-12
0.468
DAR-DIA-0cde14eb-2
0.467
DAR-DIA-0cde14eb-63
0.467
DAR-DIA-0cde14eb-62
0.467
RAL-THA-6b94ceba-7
0.467
GAB-REV-70cc3ca5-13
0.465
MAK-UNK-6435e6c2-8
0.464
AAR-POS-d2a4d1df-3
0.464
MAT-POS-f42f3716-2
0.464
MAT-POS-590ac91e-9
0.463
WIL-MOD-03b86a88-2
0.462
DAR-DIA-0cde14eb-77
0.461
GAB-REV-70cc3ca5-23
0.461
RAL-THA-6b94ceba-5
0.461
DAR-DIA-0cde14eb-3
0.461
DAR-DIA-0cde14eb-4
0.461
CHR-SOS-e960e883-6
0.457
GAB-REV-70cc3ca5-21
0.456
MAT-POS-590ac91e-23
0.456
CHR-SOS-1f323c23-9
0.456
BEN-DND-93268d01-4
0.451
MAT-POS-590ac91e-24
0.449
BEN-DND-93268d01-10
0.449
MAT-POS-590ac91e-10
0.449
DAR-DIA-0cde14eb-74
0.449
RAL-THA-6b94ceba-8
0.449
EDJ-MED-e58735b6-4
0.449
PET-SGC-05cff2e1-1
0.448
GAB-REV-70cc3ca5-9
0.447
CHR-SOS-e960e883-5
0.446
BEN-DND-6de5dfa0-3
0.444
NAU-LAT-3f5f3993-5
0.444
BEN-DND-09b88bf4-3
0.444
RAL-THA-6b94ceba-9
0.443
DAR-DIA-0cde14eb-14
0.443
MAT-POS-590ac91e-17
0.443
THO-SYG-cc9e9a11-2
0.442
MAT-POS-590ac91e-7
0.441
NAU-LAT-0543f7f2-2
0.440