In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2009 | 15 | Yes |
Popular Name: 6-[[(2S)-2-(dimethylamino)propyl]amino]-2H-1,2,4-triazine-3,5-dione 6-[[(2S)-2-(dimethylamino)propyl…
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) | -0.87 | -0.06 | -40.92 | 4 | 7 | 1 | 95 | 214.249 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.41 | -4.02 | -36.9 | 2 | 7 | -1 | 97 | 212.233 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.41 | -1.74 | -49.23 | 3 | 7 | 0 | 98 | 213.241 | 4 | ↓ |