In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 19 | Yes |
Popular Name: (3R,4R)-N4-ethyl-N3-methyl-N3-(3-pyridylmethyl)heptane-3,4-diamine (3R,4R)-N4-ethyl-N3-methyl-N3-(3…
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) | 2.96 | 8 | -40.54 | 2 | 3 | 1 | 33 | 264.437 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.96 | 7.12 | -36.15 | 2 | 3 | 1 | 29 | 264.437 | 9 | ↓ |