| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 20 | Yes |
Popular Name: (1S,2S)-N1,N2-dimethyl-N2-(3-pyridylmethyl)indane-1,2-diamine (1S,2S)-N1,N2-dimethyl-N2-(3-pyr…
| 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) | 1.85 | 7.22 | -38.8 | 2 | 3 | 1 | 29 | 268.384 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.85 | 4.97 | -4.22 | 1 | 3 | 0 | 28 | 267.376 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.85 | 8.03 | -128.89 | 3 | 3 | 2 | 34 | 269.392 | 4 | ↓ |
