In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 17 | Yes |
Popular Name: (3S,4R)-N4-ethyl-N3-methyl-N3-tetrahydropyran-4-yl-tetrahydropyran-3,4-diamine (3S,4R)-N4-ethyl-N3-methyl-N3-te…
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) | 0.97 | 1.91 | -35.97 | 2 | 4 | 1 | 38 | 243.371 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.97 | 0.15 | -2.43 | 1 | 4 | 0 | 34 | 242.363 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.97 | 2.37 | -34.79 | 2 | 4 | 1 | 35 | 243.371 | 4 | ↓ |