In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: (1S,2R)-N2-methyl-N2-[[(2R)-tetrahydrofuran-2-yl]methyl]indane-1,2-diamine (1S,2R)-N2-methyl-N2-[[(2R)-tetr…
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) | -0.19 | 4.62 | -40.25 | 3 | 3 | 1 | 40 | 247.362 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.19 | 4.36 | -3.85 | 2 | 3 | 0 | 38 | 246.354 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.19 | 6.62 | -123.58 | 4 | 3 | 2 | 41 | 248.37 | 3 | ↓ |