In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 20 | Yes |
Popular Name: (3S,4S)-3-[(3S)-3-propoxy-1-piperidyl]-N-propyl-tetrahydropyran-4-amine (3S,4S)-3-[(3S)-3-propoxy-1-pipe…
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) | 2.35 | 5.26 | -35.58 | 2 | 4 | 1 | 38 | 285.452 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.35 | 3.75 | -2.22 | 1 | 4 | 0 | 34 | 284.444 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.35 | 6.08 | -30.38 | 2 | 4 | 1 | 35 | 285.452 | 7 | ↓ |