| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2011 | 21 | Yes |
Popular Name: (3S)-1-[2-(aminomethyl)indan-2-yl]-N,N-diethyl-pyrrolidin-3-amine (3S)-1-[2-(aminomethyl)indan-2-y…
| 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) | 1.90 | 6.4 | -93.11 | 4 | 3 | 2 | 35 | 289.467 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.90 | 4.35 | -47.66 | 3 | 3 | 1 | 34 | 288.459 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.90 | 6.22 | -132.64 | 4 | 3 | 2 | 35 | 289.467 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.90 | 8.31 | -214.89 | 5 | 3 | 3 | 37 | 290.475 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
