In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 19 | Yes |
Popular Name: (1S,2S)-N2-ethyl-N2-[(1S)-2-methoxy-1-methyl-ethyl]-N1-methyl-indane-1,2-diamine (1S,2S)-N2-ethyl-N2-[(1S)-2-meth…
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) | 2.38 | 4.75 | -36.69 | 2 | 3 | 1 | 29 | 263.405 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.38 | 3.54 | -3.27 | 1 | 3 | 0 | 24 | 262.397 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.38 | 7.34 | -107.84 | 3 | 3 | 2 | 30 | 264.413 | 6 | ↓ |