| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2010 | 19 | Yes |
Popular Name: N5-methyl-N5-[[(2S)-tetrahydrofuran-2-yl]methyl]isoquinoline-5,8-diamine N5-methyl-N5-[[(2S)-tetrahydrofu…
| 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) | 1.91 | 6.07 | -29.06 | 3 | 4 | 1 | 53 | 258.345 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.91 | 5.61 | -6.44 | 2 | 4 | 0 | 51 | 257.337 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
