In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 18 | Yes |
Popular Name: (2S,3R)-N2-ethyl-N3-[(2-methoxyphenyl)methyl]-N3-methyl-butane-2,3-diamine (2S,3R)-N2-ethyl-N3-[(2-methoxyp…
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) | 2.57 | 7.44 | -101.14 | 3 | 3 | 2 | 30 | 252.402 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.57 | 6.42 | -28.47 | 2 | 3 | 1 | 26 | 251.394 | 7 | ↓ |