In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2011 | 21 | Yes |
Popular Name: 2-methyl-5-[(1S)-1-(1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)ethyl]-1,3,4-oxadiazole 2-methyl-5-[(1S)-1-(1,3,4,5-tetr…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.17 | 1.68 | -10.49 | 1 | 5 | 0 | 58 | 282.347 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.17 | 3.88 | -40.52 | 2 | 5 | 1 | 59 | 283.355 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.