| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 18 | Yes |
Popular Name: (3S)-3-(aminomethyl)-N-cyclohexyl-1-isopropyl-N-methyl-pyrrolidin-3-amine (3S)-3-(aminomethyl)-N-cyclohexy…
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|
| Hi High (pH 8-9.5) | 1.95 | 3.64 | -41.52 | 3 | 3 | 1 | 34 | 254.442 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.95 | 4.75 | -30.91 | 3 | 3 | 1 | 34 | 254.442 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.94 | 6.68 | -93.05 | 4 | 3 | 2 | 35 | 255.45 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.94 | 4.16 | -26.39 | 3 | 3 | 1 | 34 | 254.442 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.94 | 5.89 | -121.12 | 4 | 3 | 2 | 35 | 255.45 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.94 | 7.04 | -219.74 | 5 | 3 | 3 | 37 | 256.458 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.94 | 4.75 | -103.29 | 4 | 3 | 2 | 35 | 255.45 | 4 | ↓ |
