| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 19 | Yes |
Popular Name: (1S,2S)-N2-(2-dimethylaminoethyl)-N2-propyl-indane-1,2-diamine (1S,2S)-N2-(2-dimethylaminoethyl…
| 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) | 0.34 | 5.53 | -92.72 | 4 | 3 | 2 | 35 | 263.429 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.34 | 7.24 | -102.32 | 4 | 3 | 2 | 35 | 263.429 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.35 | 3.05 | -43.52 | 3 | 3 | 1 | 34 | 262.421 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.35 | 5.21 | -32.41 | 3 | 3 | 1 | 34 | 262.421 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.34 | 2.73 | -2.49 | 2 | 3 | 0 | 32 | 261.413 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.34 | 4.76 | -32.97 | 3 | 3 | 1 | 34 | 262.421 | 6 | ↓ |
