In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 19 | Yes |
Popular Name: (3S,4R)-N4-ethyl-N3-(2-methoxyethyl)-N3-(3-methoxypropyl)tetrahydropyran-3,4-diamine (3S,4R)-N4-ethyl-N3-(2-methoxyet…
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) | 0.83 | 1.72 | -35.44 | 2 | 5 | 1 | 48 | 275.413 | 10 | ↓ |
Hi High (pH 8-9.5) | 0.83 | 0.5 | -3.93 | 1 | 5 | 0 | 43 | 274.405 | 10 | ↓ |
Mid Mid (pH 6-8) | 0.83 | 1.99 | -32.26 | 2 | 5 | 1 | 44 | 275.413 | 10 | ↓ |