In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 19 | Yes |
Popular Name: (3R,4R)-N3-(2-methoxyethyl)-N3-[(1S)-2-methoxy-1-methyl-ethyl]-N4-methyl-heptane-3,4-diamine (3R,4R)-N3-(2-methoxyethyl)-N3-[…
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) | 2.72 | 5.45 | -37.11 | 2 | 4 | 1 | 38 | 275.457 | 12 | ↓ |
Hi High (pH 8-9.5) | 2.72 | 2.84 | -1.11 | 1 | 4 | 0 | 34 | 274.449 | 12 | ↓ |
Mid Mid (pH 6-8) | 2.72 | 5.95 | -26.3 | 2 | 4 | 1 | 35 | 275.457 | 12 | ↓ |