In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2008 | 22 | Yes |
Popular Name: 4-[(4-ethylpiperazin-1-yl)methyl]-6-morpholino-1,3,5-triazin-2-amine 4-[(4-ethylpiperazin-1-yl)methyl…
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) | 0.09 | 5.16 | -39.6 | 3 | 8 | 1 | 85 | 308.41 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.09 | 5.14 | -36.45 | 3 | 8 | 1 | 85 | 308.41 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.09 | 2.85 | -8.52 | 2 | 8 | 0 | 84 | 307.402 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.09 | 5.61 | -87.61 | 4 | 8 | 2 | 86 | 309.418 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.09 | 5.51 | -88.78 | 4 | 8 | 2 | 86 | 309.418 | 4 | ↓ |