| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2008 | 18 | Yes |
Popular Name: (2S)-N-[(2-methoxyphenyl)methyl]-N',N',3-trimethyl-butane-1,2-diamine (2S)-N-[(2-methoxyphenyl)methyl]…
| 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) | 2.64 | 6.13 | -33.97 | 2 | 3 | 1 | 29 | 251.394 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.64 | 6.83 | -32.84 | 2 | 3 | 1 | 26 | 251.394 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.64 | 8.14 | -108.26 | 3 | 3 | 2 | 30 | 252.402 | 7 | ↓ |
