| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 15th, 2011 | 21 | Yes |
Popular Name: [(2S,4R)-4-(dimethylamino)-1-[(5-methyl-1H-indol-3-yl)methyl]pyrrolidin-2-yl]methanol [(2S,4R)-4-(dimethylamino)-1-[(5…
| 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) | 1.82 | 4.52 | -34.5 | 3 | 4 | 1 | 44 | 288.415 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.82 | 2.08 | -7.36 | 2 | 4 | 0 | 42 | 287.407 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.82 | 4.28 | -39.66 | 3 | 4 | 1 | 44 | 288.415 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.82 | 6.91 | -103.84 | 4 | 4 | 2 | 45 | 289.423 | 4 | ↓ |
