Entry |
|
Name |
Safingol hydrochloride (USAN) |
Formula |
C18H39NO2. HCl
|
Exact mass |
337.2748
|
Mol weight |
337.97
|
Structure |

|
Simcomp |
|
Efficacy |
Antineoplastic, Antipsoriatic, Protein kinase C inhibitor |
Target |
|
Brite |
Target-based classification of drugs [BR:br08310]
Protein kinases
Serine/threonine kinases
AGC group
PRKCB
D05785 Safingol hydrochloride (USAN)
PRKCD
D05785 Safingol hydrochloride (USAN)
PRKCE
D05785 Safingol hydrochloride (USAN)
Enzymes
Transferases (EC2)
Phosphotransferase
PIK3C3
D05785 Safingol hydrochloride (USAN)
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 22
1 O1a O 20.7534 -32.8402
2 C1b C 21.9813 -32.1312
3 C1c C 23.2094 -32.8402
4 C1c C 24.4374 -32.1312
5 N1a N 23.2094 -34.2579
6 O1a O 24.4374 -30.7132
7 C1b C 25.6674 -32.8414
8 C1b C 26.8793 -32.1415
9 C1b C 28.0813 -32.8355
10 C1b C 29.2881 -32.1385
11 C1b C 30.4928 -32.8340
12 C1b C 31.6981 -32.1378
13 C1b C 32.9035 -32.8336
14 C1b C 34.1086 -32.1376
15 C1b C 35.3140 -32.8335
16 C1b C 36.5191 -32.1375
17 C1b C 37.7247 -32.8334
18 C1b C 38.9296 -32.1375
19 C1b C 40.1352 -32.8334
20 C1b C 41.3402 -32.1375
21 C1a C 42.5457 -32.8334
22 X Cl 40.2500 -35.2800
BOND 20
1 1 2 1
2 2 3 1
3 3 4 1
4 3 5 1 #Up
5 4 6 1 #Up
6 4 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 11 12 1
12 12 13 1
13 13 14 1
14 14 15 1
15 15 16 1
16 16 17 1
17 17 18 1
18 18 19 1
19 19 20 1
20 20 21 1
|