| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 16 | Yes |
Popular Name: (1R,2S)-N1-(2-methoxyethyl)-N1-methyl-1-(5-methyl-2-thienyl)propane-1,2-diamine (1R,2S)-N1-(2-methoxyethyl)-N1-m…
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| 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) | 1.24 | 4.45 | -32.47 | 3 | 3 | 1 | 40 | 243.396 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.24 | 2.13 | -2.54 | 2 | 3 | 0 | 38 | 242.388 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.24 | 2.39 | -36.59 | 3 | 3 | 1 | 40 | 243.396 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.24 | 4.75 | -109.78 | 4 | 3 | 2 | 41 | 244.404 | 6 | ↓ |
