| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 21 | Yes |
Popular Name: (1S,2S)-N1-methyl-1-(p-tolyl)-N1-[[(2S)-tetrahydropyran-2-yl]methyl]butane-1,2-diamine (1S,2S)-N1-methyl-1-(p-tolyl)-N1…
| 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) | 2.99 | 8.6 | -114.45 | 4 | 3 | 2 | 41 | 292.467 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.99 | 8.27 | -30.48 | 3 | 3 | 1 | 40 | 291.459 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.99 | 7.11 | -41.18 | 3 | 3 | 1 | 40 | 291.459 | 6 | ↓ |
