| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2008 | 31 | Yes |
Popular Name: (2S,4R)-4-(2-adamantylamino)-N-isopropyl-1-(1-propyl-4-piperidyl)pyrrolidine-2-carboxamide (2S,4R)-4-(2-adamantylamino)-N-i…
| 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) | 4.08 | 10.07 | -134.34 | 4 | 5 | 2 | 53 | 432.697 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.08 | 10.33 | -100.67 | 4 | 5 | 2 | 53 | 432.697 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.08 | 9.59 | -37.71 | 3 | 5 | 1 | 49 | 431.689 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.08 | 8.04 | -54.8 | 3 | 5 | 1 | 52 | 431.689 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.08 | 9.15 | -36.21 | 3 | 5 | 1 | 49 | 431.689 | 7 | ↓ |
