In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 13 | Yes |
Popular Name: 2-methyl-N1-[[(2S)-tetrahydropyran-2-yl]methyl]propane-1,2-diamine 2-methyl-N1-[[(2S)-tetrahydropyr…
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) | 0.85 | 2.33 | -116.42 | 5 | 3 | 2 | 53 | 188.315 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.85 | 2.06 | -35.7 | 4 | 3 | 1 | 52 | 187.307 | 4 | ↓ |