| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 3rd, 2010 | 18 | Yes |
Popular Name: N-methyl-N-[[(2S,4S)-2-methyl-2-phenyl-1,3-dioxolan-4-yl]methyl]ethane-1,2-diamine N-methyl-N-[[(2S,4S)-2-methyl-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) | 0.98 | 2.64 | -45.1 | 3 | 4 | 1 | 49 | 251.35 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.98 | 4.65 | -36.68 | 3 | 4 | 1 | 49 | 251.35 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.98 | 5.04 | -119.06 | 4 | 4 | 2 | 51 | 252.358 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
