In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 18 | Yes |
Popular Name: (3S,4R)-N3-methyl-N4-propyl-N3-tetrahydropyran-4-yl-tetrahydropyran-3,4-diamine (3S,4R)-N3-methyl-N4-propyl-N3-t…
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) | 1.47 | 2.66 | -36.67 | 2 | 4 | 1 | 38 | 257.398 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.47 | 0.91 | -2.33 | 1 | 4 | 0 | 34 | 256.39 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.47 | 3.14 | -34.99 | 2 | 4 | 1 | 35 | 257.398 | 5 | ↓ |