| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 19 | Yes |
Popular Name: (1S)-N'-(2-dimethylaminoethyl)-1-(3-methoxyphenyl)-N,N-dimethyl-ethane-1,2-diamine (1S)-N'-(2-dimethylaminoethyl)-1…
| 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) | 1.42 | 3.15 | -37.11 | 2 | 4 | 1 | 32 | 266.409 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.42 | 5.61 | -37.3 | 2 | 4 | 1 | 29 | 266.409 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.42 | 5.41 | -34.19 | 2 | 4 | 1 | 29 | 266.409 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.42 | 2.93 | -3.19 | 1 | 4 | 0 | 28 | 265.401 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.42 | 5.62 | -109.23 | 3 | 4 | 2 | 34 | 267.417 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.42 | 7.66 | -205.18 | 4 | 4 | 3 | 35 | 268.425 | 8 | ↓ |
