| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 19 | Yes |
Popular Name: (3R,4R)-N3-(2-dimethylaminoethyl)-N4-ethyl-N3-isobutyl-tetrahydropyran-3,4-diamine (3R,4R)-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) | 1.75 | 5.39 | -108.39 | 3 | 4 | 2 | 34 | 273.465 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.75 | 3.88 | -33.08 | 2 | 4 | 1 | 32 | 272.457 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.75 | 5.52 | -36.75 | 2 | 4 | 1 | 29 | 272.457 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.75 | 3.05 | -0.99 | 1 | 4 | 0 | 28 | 271.449 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.75 | 4.24 | -31.13 | 2 | 4 | 1 | 29 | 272.457 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.75 | 6.36 | -100.78 | 3 | 4 | 2 | 34 | 273.465 | 8 | ↓ |
