| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2005 | 30 | No |
Popular Name: propyl 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) | 4.23 | 0.09 | -10.11 | 0 | 5 | 0 | 68 | 402.494 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.41 | -1.16 | -9.9 | 0 | 5 | 0 | 68 | 402.494 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.23 | -0.05 | -12.31 | 0 | 5 | 0 | 68 | 402.494 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.41 | -0.99 | -33.55 | 1 | 5 | 1 | 69 | 403.502 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.23 | 0.25 | -29.6 | 1 | 5 | 1 | 69 | 403.502 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.23 | 0.13 | -35.35 | 1 | 5 | 1 | 69 | 403.502 | 6 | ↓ |
