In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 17 | Yes |
Popular Name: 6-[3-aminopropyl(isobutyl)amino]-2H-1,2,4-triazine-3,5-dione 6-[3-aminopropyl(isobutyl)amino]…
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) | -0.79 | 0.19 | -47.16 | 5 | 7 | 1 | 109 | 242.303 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.33 | -1.41 | -62.66 | 4 | 7 | 0 | 113 | 241.295 | 6 | ↓ |