| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 20 | Yes |
Popular Name: (3S)-3-(aminomethyl)-1-isopropyl-N-methyl-N-(p-tolylmethyl)pyrrolidin-3-amine (3S)-3-(aminomethyl)-1-isopropyl…
| 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) | 1.89 | 7.84 | -101.5 | 4 | 3 | 2 | 35 | 277.456 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.89 | 5.69 | -34.5 | 3 | 3 | 1 | 34 | 276.448 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.89 | 4.07 | -46.29 | 3 | 3 | 1 | 34 | 276.448 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.89 | 5.42 | -31.43 | 3 | 3 | 1 | 34 | 276.448 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.89 | 6.34 | -111.71 | 4 | 3 | 2 | 35 | 277.456 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.89 | 8.21 | -233.3 | 5 | 3 | 3 | 37 | 278.464 | 5 | ↓ |
