| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 18 | Yes |
Popular Name: (1R,2S)-N1-cyclopropyl-N1-(2-methoxyethyl)-1-(3-methyl-2-thienyl)propane-1,2-diamine (1R,2S)-N1-cyclopropyl-N1-(2-met…
| 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) | 1.76 | 5.27 | -24.7 | 3 | 3 | 1 | 40 | 269.434 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.76 | 3.55 | -2.74 | 2 | 3 | 0 | 38 | 268.426 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.76 | 3.88 | -41.65 | 3 | 3 | 1 | 40 | 269.434 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.76 | 5.28 | -101.9 | 4 | 3 | 2 | 41 | 270.442 | 7 | ↓ |
