In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 21 | Yes |
Popular Name: (1R,2R)-N1-ethyl-N2-isobutyl-N2-(2-methoxyethyl)indane-1,2-diamine (1R,2R)-N1-ethyl-N2-isobutyl-N2-…
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) | 3.17 | 7.1 | -39.27 | 2 | 3 | 1 | 29 | 291.459 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.17 | 5.97 | -3.87 | 1 | 3 | 0 | 24 | 290.451 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.17 | 7.2 | -30.55 | 2 | 3 | 1 | 26 | 291.459 | 8 | ↓ |