| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 17 | Yes |
Popular Name: (3S)-3-(aminomethyl)-N-cyclopentyl-1-isopropyl-N-methyl-pyrrolidin-3-amine (3S)-3-(aminomethyl)-N-cyclopent…
| 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) | 1.44 | 3.44 | -42.53 | 3 | 3 | 1 | 34 | 240.415 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.44 | 4.28 | -30.11 | 3 | 3 | 1 | 34 | 240.415 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.44 | 5.07 | -28.23 | 3 | 3 | 1 | 34 | 240.415 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.44 | 6.06 | -92.28 | 4 | 3 | 2 | 35 | 241.423 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.44 | 5.43 | -119.57 | 4 | 3 | 2 | 35 | 241.423 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.44 | 6.44 | -217.84 | 5 | 3 | 3 | 37 | 242.431 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.44 | 4.67 | -101.92 | 4 | 3 | 2 | 35 | 241.423 | 4 | ↓ |
