| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 19 | Yes |
Popular Name: (3S)-3-(aminomethyl)-N-benzyl-1-isopropyl-N-methyl-pyrrolidin-3-amine (3S)-3-(aminomethyl)-N-benzyl-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) | 1.44 | 5.87 | -126.15 | 4 | 3 | 2 | 35 | 263.429 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.44 | 5.06 | -34.02 | 3 | 3 | 1 | 34 | 262.421 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.44 | 5.39 | -28.22 | 3 | 3 | 1 | 34 | 262.421 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.44 | 4.01 | -46.37 | 3 | 3 | 1 | 34 | 262.421 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.44 | 7.33 | -101.52 | 4 | 3 | 2 | 35 | 263.429 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.44 | 5.95 | -109.84 | 4 | 3 | 2 | 35 | 263.429 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.44 | 7.67 | -232.42 | 5 | 3 | 3 | 37 | 264.437 | 5 | ↓ |
