In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 19 | Yes |
Popular Name: 4-[butyl-[2-[(2S)-1-methyl-2-piperidyl]ethyl]amino]butan-1-ol 4-[butyl-[2-[(2S)-1-methyl-2-pip…
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) | 2.89 | 8.31 | -104.09 | 3 | 3 | 2 | 29 | 272.477 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.89 | 5.99 | -39.56 | 2 | 3 | 1 | 28 | 271.469 | 10 | ↓ |