In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 21 | Yes |
Popular Name: 4-[(3S)-3-[[(2R,4R,5R)-1,2,5-trimethyl-4-piperidyl]amino]butyl]phenol 4-[(3S)-3-[[(2R,4R,5R)-1,2,5-tri…
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) | 3.50 | 5.19 | -41.69 | 3 | 3 | 1 | 40 | 291.459 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.50 | 7.46 | -107.41 | 4 | 3 | 2 | 41 | 292.467 | 5 | ↓ |