| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 17 | Yes |
Popular Name: (3S,4R)-N3-(cyclohexylmethyl)-N3,N4-dimethyl-tetrahydropyran-3,4-diamine (3S,4R)-N3-(cyclohexylmethyl)-N3…
| 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) | 2.51 | 6.41 | -115.58 | 3 | 3 | 2 | 30 | 242.407 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.51 | 3.5 | -1.03 | 1 | 3 | 0 | 24 | 240.391 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.51 | 4.72 | -36.93 | 2 | 3 | 1 | 29 | 241.399 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.51 | 5.15 | -34.41 | 2 | 3 | 1 | 26 | 241.399 | 4 | ↓ |
