In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 21 | Yes |
Popular Name: (1R,2S)-N2-ethyl-N2-[(1S)-2-methoxy-1-methyl-ethyl]-N1-propyl-indane-1,2-diamine (1R,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) | 3.26 | 7.99 | -29.64 | 2 | 3 | 1 | 29 | 291.459 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.26 | 6.31 | -2.92 | 1 | 3 | 0 | 24 | 290.451 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.26 | 8.16 | -32.92 | 2 | 3 | 1 | 26 | 291.459 | 8 | ↓ |