| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 18 | Yes |
Popular Name: (3S)-1-[(2-bromophenyl)methyl]-N,N-diethyl-pyrrolidin-3-amine (3S)-1-[(2-bromophenyl)methyl]-N…
| 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) | 3.40 | 8.17 | -30.56 | 1 | 2 | 1 | 8 | 312.275 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.40 | 5.77 | -2.2 | 0 | 2 | 0 | 6 | 311.267 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.40 | 7.89 | -32.76 | 1 | 2 | 1 | 8 | 312.275 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.40 | 10.33 | -101.75 | 2 | 2 | 2 | 9 | 313.283 | 5 | ↓ |
