| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 21 | Yes |
Popular Name: (1S,2R)-N1-ethyl-N2-methyl-N2-(3-pyridylmethyl)indane-1,2-diamine (1S,2R)-N1-ethyl-N2-methyl-N2-(3…
| 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) | 2.23 | 7.96 | -37.65 | 2 | 3 | 1 | 33 | 282.411 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.23 | 8.25 | -38.43 | 2 | 3 | 1 | 29 | 282.411 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.23 | 9.17 | -120.24 | 3 | 3 | 2 | 34 | 283.419 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.23 | 8.43 | -90.71 | 3 | 3 | 2 | 34 | 283.419 | 5 | ↓ |
