| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 18th, 2008 | 30 | Yes |
Popular Name: N-[2-[bis[2-(bis(3-aminopropyl)amino)ethyl]amino]ethyl]propane-1,3-diamine N-[2-[bis[2-(bis(3-aminopropyl)a…
| 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) | -4.58 | -6.89 | -330.9 | 16 | 9 | 5 | 160 | 436.758 | 24 | ↓ |
| Mid Mid (pH 6-8) | -4.58 | -5.53 | -461.16 | 17 | 9 | 6 | 165 | 437.766 | 24 | ↓ |
| Mid Mid (pH 6-8) | -4.58 | -3.53 | -642.15 | 18 | 9 | 7 | 166 | 438.774 | 24 | ↓ |
| Mid Mid (pH 6-8) | -4.58 | -4.84 | -452.41 | 17 | 9 | 6 | 161 | 437.766 | 24 | ↓ |
| Lo Low (pH 4.5-6) | -4.58 | -1.34 | -807.2 | 19 | 9 | 8 | 167 | 439.782 | 24 | ↓ |
| Lo Low (pH 4.5-6) | -4.58 | -3.46 | -616.74 | 18 | 9 | 7 | 166 | 438.774 | 24 | ↓ |
