| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 18 | Yes |
Popular Name: (3S)-3-(aminomethyl)-1-isopropyl-N-methyl-N-(thiazol-4-ylmethyl)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) | 0.61 | 4.39 | -96 | 4 | 4 | 2 | 48 | 270.446 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.61 | 0.28 | -45 | 3 | 4 | 1 | 47 | 269.438 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.61 | 2.34 | -32.58 | 3 | 4 | 1 | 47 | 269.438 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.61 | 2.7 | -106.18 | 4 | 4 | 2 | 48 | 270.446 | 5 | ↓ |
