| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 21 | Yes |
Popular Name: (3R)-1-[4-(aminomethyl)-2-isopropyl-pyrimidin-5-yl]-N,N-diethyl-pyrrolidin-3-amine (3R)-1-[4-(aminomethyl)-2-isopro…
| 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) | 1.73 | 6.28 | -102.27 | 4 | 5 | 2 | 61 | 293.459 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.73 | 3.78 | -4.17 | 2 | 5 | 0 | 58 | 291.443 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.73 | 4.18 | -44.22 | 3 | 5 | 1 | 60 | 292.451 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
