| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 20 | Yes |
Popular Name: (3R,4S)-N3-(2-dimethylaminoethyl)-N3-propyl-chromane-3,4-diamine (3R,4S)-N3-(2-dimethylaminoethyl…
| 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) | 0.22 | 6.39 | -112.17 | 4 | 4 | 2 | 44 | 279.428 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.22 | 2.3 | -44.97 | 3 | 4 | 1 | 43 | 278.42 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.22 | 4.48 | -40.15 | 3 | 4 | 1 | 43 | 278.42 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.22 | 2.02 | -3.35 | 2 | 4 | 0 | 42 | 277.412 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.22 | 3.93 | -36.89 | 3 | 4 | 1 | 43 | 278.42 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.22 | 4.78 | -110.75 | 4 | 4 | 2 | 45 | 279.428 | 6 | ↓ |
