| 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 | 0.41 | -11.03 | 0 | 5 | 0 | 68 | 402.494 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.41 | -1.06 | -10.06 | 0 | 5 | 0 | 68 | 402.494 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.23 | 0.01 | -12.67 | 0 | 5 | 0 | 68 | 402.494 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.41 | -0.89 | -31.99 | 1 | 5 | 1 | 69 | 403.502 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.23 | 0.56 | -31.63 | 1 | 5 | 1 | 69 | 403.502 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.23 | 0.18 | -34.19 | 1 | 5 | 1 | 69 | 403.502 | 6 | ↓ |
