In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 16 | Yes |
Popular Name: (3R,4S)-N3-[(1S)-2-methoxy-1-methyl-ethyl]-N3,N4-dimethyl-heptane-3,4-diamine (3R,4S)-N3-[(1S)-2-methoxy-1-met…
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) | 2.73 | 5.87 | -101.44 | 3 | 3 | 2 | 30 | 232.412 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.73 | 4.79 | -27.41 | 2 | 3 | 1 | 26 | 231.404 | 9 | ↓ |