| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 19 | Yes |
Popular Name: (3S)-3-(aminomethyl)-1-isopropyl-N-methyl-N-[(2-methylthiazol-4-yl)methyl]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) | 0.32 | 5.23 | -96.07 | 4 | 4 | 2 | 48 | 284.473 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.32 | 1.43 | -49.62 | 3 | 4 | 1 | 47 | 283.465 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.32 | 3.05 | -35.65 | 3 | 4 | 1 | 47 | 283.465 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.32 | 3.7 | -112.45 | 4 | 4 | 2 | 48 | 284.473 | 5 | ↓ |
