Official websites use .gov
A
.gov website belongs to an official
government organization in the United States.
Secure .gov websites use HTTPS
A lock (
) or https:// means you've safely
connected to the .gov website. Share sensitive
information only on official, secure websites.
Drug-likeliness of top five lead compounds.
| IBS no. | MW | cLogP | HBD, n | HBA, n | TPSA | Mutagenicity | Carcinogenicity |
|---|---|---|---|---|---|---|---|
| 05678 | 314.419 | 4.41 | 1 | 3 | 38.69 | No | No |
| 46780 | 405.401 | 3.35 | 2 | 7 | 109.57 | No | No |
| 49515 | 413.183 | 3.65 | 2 | 7 | 109.75 | No | No |
| 49817 | 405.151 | 3.94 | 3 | 8 | 129.28 | No | No |
| 64118 | 405.121 | 3.12 | 2 | 6 | 96.28 | No | No |
cLogP, octanol/water partition coefficient; TPSA, total polar surface area; IBS, Interbioscreen; HBA, hydrogen bond acceptor; HBD, hydrogen bond donor.
