| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 20 | Yes |
Popular Name: (3S)-3-(aminomethyl)-1-isopropyl-N-methyl-N-(m-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) | 1.86 | 5.78 | -127.04 | 4 | 3 | 2 | 35 | 277.456 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.86 | 5.62 | -33.29 | 3 | 3 | 1 | 34 | 276.448 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.86 | 4.07 | -46.19 | 3 | 3 | 1 | 34 | 276.448 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.86 | 5.29 | -29.29 | 3 | 3 | 1 | 34 | 276.448 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.86 | 7.72 | -102.04 | 4 | 3 | 2 | 35 | 277.456 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.86 | 6.33 | -111.68 | 4 | 3 | 2 | 35 | 277.456 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.86 | 8.2 | -233.88 | 5 | 3 | 3 | 37 | 278.464 | 5 | ↓ |
