| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2010 | 15 | Yes |
Popular Name: (3S,4S)-N3-methyl-N3-[(1R)-1,2,2-trimethylpropyl]tetrahydropyran-3,4-diamine (3S,4S)-N3-methyl-N3-[(1R)-1,2,2…
| 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) | 1.34 | 2.42 | -42.13 | 3 | 3 | 1 | 40 | 215.361 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.34 | 2.06 | -1.37 | 2 | 3 | 0 | 38 | 214.353 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.34 | 3.71 | -115.45 | 4 | 3 | 2 | 41 | 216.369 | 3 | ↓ |
