In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 21 | Yes |
Popular Name: N,N-dimethyl-1-[(2S)-2-phenyl-2-(propylamino)ethyl]piperidin-4-amine N,N-dimethyl-1-[(2S)-2-phenyl-2-…
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) | 3.01 | 9.21 | -89.03 | 3 | 3 | 2 | 24 | 291.483 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.01 | 7.44 | -34.26 | 2 | 3 | 1 | 20 | 290.475 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.01 | 7.62 | -32.91 | 2 | 3 | 1 | 20 | 290.475 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.01 | 10.05 | -99.03 | 3 | 3 | 2 | 21 | 291.483 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.01 | 11.09 | -211.67 | 4 | 3 | 3 | 25 | 292.491 | 7 | ↓ |