| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 30th, 2008 | 26 | Yes |
Popular Name: (2S,4S)-4-(2-adamantylamino)-1-isopropyl-N-(2-methoxyethyl)pyrrolidine-2-carboxamide (2S,4S)-4-(2-adamantylamino)-1-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) | 2.77 | 5.26 | -47.66 | 3 | 5 | 1 | 58 | 364.554 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.77 | 4.62 | -7.46 | 2 | 5 | 0 | 54 | 363.546 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.77 | 7.34 | -121.77 | 4 | 5 | 2 | 59 | 365.562 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
