In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 20 | Yes |
Popular Name: (1S,2R)-N2-ethyl-N1-methyl-N2-[[(2S)-tetrahydrofuran-2-yl]methyl]indane-1,2-diamine (1S,2R)-N2-ethyl-N1-methyl-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) | 2.44 | 6.91 | -31.88 | 2 | 3 | 1 | 29 | 275.416 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.44 | 5.92 | -3.02 | 1 | 3 | 0 | 24 | 274.408 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.44 | 8.89 | -111.36 | 3 | 3 | 2 | 30 | 276.424 | 5 | ↓ |