In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 12 | Yes |
Popular Name: N-methyl-N'-[[(2R)-tetrahydropyran-2-yl]methyl]ethane-1,2-diamine N-methyl-N'-[[(2R)-tetrahydropyr…
None
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) | 0.41 | 2.69 | -109.98 | 4 | 3 | 2 | 42 | 174.288 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.41 | -0.1 | -1.88 | 2 | 3 | 0 | 33 | 172.272 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.41 | 1.35 | -35.69 | 3 | 3 | 1 | 38 | 173.28 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.41 | 1.25 | -35.47 | 3 | 3 | 1 | 38 | 173.28 | 5 | ↓ |