In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 15 | Yes |
Popular Name: N1-[[(2S)-tetrahydropyran-2-yl]methyl]benzene-1,4-diamine N1-[[(2S)-tetrahydropyran-2-yl]m…
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) | 1.75 | 3.06 | -3.78 | 3 | 3 | 0 | 47 | 206.289 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.75 | 2.92 | -40.3 | 4 | 3 | 1 | 49 | 207.297 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.75 | 3.69 | -32.62 | 4 | 3 | 1 | 52 | 207.297 | 3 | ↓ |