In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2009 | 14 | Yes |
Popular Name: [1-[(1R)-3-amino-1-ethyl-propyl]-4-piperidyl]methanol [1-[(1R)-3-amino-1-ethyl-propyl]…
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) | 0.42 | 1.61 | -107.61 | 5 | 3 | 2 | 52 | 202.342 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.42 | -0.29 | -42.74 | 4 | 3 | 1 | 51 | 201.334 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.42 | 1.23 | -31.38 | 4 | 3 | 1 | 51 | 201.334 | 5 | ↓ |