| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 1st, 2009 | 20 | No |
Popular Name: (5S)-5-methyl-3-(4-methylpiperazin-1-yl)-6-phenyl-2,5-dihydro-1,2,4-triazine (5S)-5-methyl-3-(4-methylpiperaz…
| 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) | 1.63 | 6.82 | -27.09 | 2 | 5 | 1 | 45 | 272.376 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.63 | 8.78 | -41.32 | 2 | 5 | 1 | 44 | 272.376 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.63 | 6.42 | -6.66 | 1 | 5 | 0 | 43 | 271.368 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.63 | 9.17 | -92.45 | 3 | 5 | 2 | 46 | 273.384 | 2 | ↓ |
