| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 17 | Yes |
Popular Name: (2S,3S)-N3-methyl-N2-propyl-N3-[[(2S)-tetrahydropyran-2-yl]methyl]butane-2,3-diamine (2S,3S)-N3-methyl-N2-propyl-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) | 2.55 | 5.33 | -35 | 2 | 3 | 1 | 29 | 243.415 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.55 | 4.26 | -1.48 | 1 | 3 | 0 | 24 | 242.407 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.55 | 6.22 | -29.77 | 2 | 3 | 1 | 26 | 243.415 | 7 | ↓ |
