In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2009 | 16 | Yes |
Popular Name: 1-[(3S,4S)-4-aminotetrahydropyran-3-yl]-N,N-dimethyl-piperidin-4-amine 1-[(3S,4S)-4-aminotetrahydropyra…
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) | -0.27 | 2.3 | -93.12 | 4 | 4 | 2 | 45 | 229.368 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.27 | 1.82 | -35.08 | 3 | 4 | 1 | 43 | 228.36 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.27 | 1.02 | -118.27 | 4 | 4 | 2 | 45 | 229.368 | 2 | ↓ |