| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 18 | Yes |
Popular Name: (3S,4S)-N3-(1-ethylpropyl)-N3-methyl-chromane-3,4-diamine (3S,4S)-N3-(1-ethylpropyl)-N3-me…
| 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) | 1.06 | 4.72 | -37.97 | 3 | 3 | 1 | 40 | 249.378 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.06 | 4.42 | -3.2 | 2 | 3 | 0 | 38 | 248.37 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.06 | 5.63 | -32.83 | 3 | 3 | 1 | 40 | 249.378 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.06 | 5.95 | -115.14 | 4 | 3 | 2 | 41 | 250.386 | 4 | ↓ |
