In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 16 | Yes |
Popular Name: (2S,3R)-N2,3-dimethyl-N2-[[(2S)-tetrahydropyran-2-yl]methyl]pentane-1,2-diamine (2S,3R)-N2,3-dimethyl-N2-[[(2S)-…
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) | 1.64 | 3.1 | -38.87 | 3 | 3 | 1 | 40 | 229.388 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 4.73 | -28.93 | 3 | 3 | 1 | 40 | 229.388 | 6 | ↓ |