| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2005 | 30 | No |
Popular Name: isopropyl isopropyl
| 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) | 4.09 | 0.05 | -10.89 | 0 | 5 | 0 | 68 | 402.494 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.09 | 0.1 | -13.23 | 0 | 5 | 0 | 68 | 402.494 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.27 | 1.38 | -12.84 | 0 | 5 | 0 | 68 | 402.494 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.27 | 0.05 | -10.93 | 0 | 5 | 0 | 68 | 402.494 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.09 | 0.28 | -33.99 | 1 | 5 | 1 | 69 | 403.502 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.27 | 1.56 | -29.79 | 1 | 5 | 1 | 69 | 403.502 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.09 | 1.42 | -29.61 | 1 | 5 | 1 | 69 | 403.502 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.27 | 0.23 | -31.4 | 1 | 5 | 1 | 69 | 403.502 | 5 | ↓ |
