Molecular Properties | |
SMILES: | O=C(Nc1cccnc1)Oc1ccccc1 |
MW: | 214.224 |
Fraction sp3: | 0.0 |
HBA: | 3 |
HBD: | 1 |
Rotatable Bonds: | 2 |
TPSA: | 51.22 |
cLogP: | 2.6925 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
Enamine SCR: | Z31792088 |
Mcule: | MCULE-9348900594 |
MolPort: | MolPort-004-129-606 |
carbamate include di-substitued N
Phenylester
ALE-HEI-f28a35b5-9
AGN-NEW-891393a6-2
0.559
AGN-NEW-891393a6-1
0.541
AAR-POS-d2a4d1df-11
0.500
WIL-UNI-5578df48-2
0.473
SAN-PRS-52b81272-2
0.464
CHR-SOS-70e4c98a-6
0.460
MAR-TRE-67513f76-81
0.460
MAK-UNK-ca11b4f7-3
0.451
MAK-UNK-ca11b4f7-2
0.451
JOH-IMS-62aeb97d-1
0.450
CHR-SOS-70e4c98a-8
0.446
MAK-UNK-ca11b4f7-1
0.442
JOH-IMS-62aeb97d-5
0.442
AUS-ARG-7cfdce8f-11
0.441
CHR-SOS-70e4c98a-3
0.433
WIL-UNI-5578df48-3
0.431
CHR-SOS-7098f804-16
0.429
ALE-HEI-f28a35b5-15
0.421
CHR-SOS-7098f804-18
0.420
CHR-SOS-70e4c98a-1
0.420
SWA-SYN-59528602-3
0.417
SAD-SAT-689b7d5a-4
0.403
WIL-UNI-5578df48-4
0.403
MAR-TRE-04c86cea-97
0.403
MAK-UNK-d1e89583-1
0.400
WIL-UNI-5578df48-1
0.400
CHR-SOS-7098f804-14
0.397
ALE-HEI-f28a35b5-14
0.397
JOH-UNK-14e6adc5-2
0.393
ANN-UNI-26382800-3
0.393
MAR-TRE-2fd8122f-97
0.391
KEI-TRE-d5e2018a-81
0.391
EMI-TUK-a58865cc-3
0.391
ADA-UNI-f8e79267-4
0.391
MAK-UNK-a7b37c5e-2
0.391
DAR-DIA-842b4336-1
0.390
CHR-SOS-f7373dd1-4
0.388
MAK-UNK-d1e89583-9
0.388
MAR-TRE-74c6519b-47
0.388
CHR-SOS-363cfb78-3
0.387
SAD-SAT-24589cd1-4
0.383
WAR-XCH-eb7b662f-3
0.383
ADA-UNI-f8e79267-5
0.382
MAR-TRE-7f7bb9f0-90
0.382
DAR-DIA-23aa0b97-16
0.381
MAK-UNK-a7b37c5e-1
0.381
EMI-TUK-a58865cc-6
0.380
MAK-UNK-d1e89583-6
0.379
SAD-SAT-689b7d5a-9
0.379
MAR-TRE-f6f5f473-78
0.379
MAR-TRE-04c86cea-46
0.378
MAR-TRE-2fd8122f-27
0.377
DAR-DIA-842b4336-2
0.377
DAR-DIA-23aa0b97-15
0.377
MAK-UNK-a7b37c5e-4
0.377
CHR-SOS-59746812-1
0.377
ADA-UNI-f8e79267-6
0.377
CHR-SOS-f7373dd1-1
0.377
EMI-TUK-a58865cc-5
0.377
DAR-DIA-842b4336-8
0.375
MED-UNK-e6e8ef8a-1
0.375
EDG-MED-0da5ad92-2
0.375
ADA-UNI-f8e79267-2
0.375
SAD-SAT-689b7d5a-3
0.373
ANT-DIA-3c79be55-4
0.373
MAK-UNK-d1e89583-3
0.373
BEN-DND-362d364a-12
0.371
DRE-WAB-ae4a693c-1
0.371
PET-SGC-d0156db4-1
0.371
ASH-UNK-40b46b30-3
0.371
PET-SGC-b0f8bd49-1
0.371
CHR-SOS-59746812-5
0.371
JOR-UNI-2fc98d0b-7
0.371
MAK-UNK-a7b37c5e-5
0.371
WAR-XCH-eb7b662f-7
0.371
DAR-DIA-842b4336-3
0.371
DAR-DIA-842b4336-4
0.371
WAR-XCH-eb7b662f-6
0.371
JOH-IMS-62aeb97d-4
0.371
ALE-HEI-f28a35b5-16
0.371
JAN-GHE-83b26c96-19
0.371
DAR-DIA-23aa0b97-14
0.371
MAR-TRE-f6f5f473-29
0.370
ADA-UNI-f8e79267-1
0.370
KEI-TRE-d5e2018a-28
0.370
MAR-TRE-9c797165-46
0.369
CHR-SOS-7098f804-11
0.369
MAR-TRE-7f7bb9f0-46
0.368
CHR-SOS-7098f804-13
0.366
EMI-TUK-a58865cc-7
0.366
MAK-UNK-d1e89583-4
0.365
ALE-HEI-f28a35b5-8
0.365
MAK-UNK-d1e89583-7
0.365
DAR-DIA-842b4336-10
0.365
CHR-SOS-7098f804-12
0.365
DAR-DIA-842b4336-9
0.364
KEI-TRE-d5e2018a-38
0.362
MAK-UNK-d1e89583-8
0.362
KEI-TRE-d5e2018a-27
0.361
MAR-TRE-7f7bb9f0-16
0.361