| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 20 | Yes |
Popular Name: (3R,4S)-N3-isobutyl-N3-isopropyl-N4-methyl-chromane-3,4-diamine (3R,4S)-N3-isobutyl-N3-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) | 3.36 | 6.64 | -36.52 | 2 | 3 | 1 | 29 | 277.432 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.36 | 4.81 | -2.32 | 1 | 3 | 0 | 24 | 276.424 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.36 | 6.41 | -31.14 | 2 | 3 | 1 | 26 | 277.432 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.36 | 7.61 | -113.16 | 3 | 3 | 2 | 30 | 278.44 | 5 | ↓ |
