| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2010 | 18 | Yes |
Popular Name: (3S)-1-[(4-ethylcyclohexyl)methyl]-N-propyl-pyrrolidin-3-amine (3S)-1-[(4-ethylcyclohexyl)methy…
| 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) | 3.87 | 8.68 | -33.07 | 2 | 2 | 1 | 16 | 253.454 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.87 | 6.51 | -0.19 | 1 | 2 | 0 | 15 | 252.446 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.87 | 7.7 | -36.18 | 2 | 2 | 1 | 20 | 253.454 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.87 | 9.86 | -111.24 | 3 | 2 | 2 | 21 | 254.462 | 6 | ↓ |
