In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 30th, 2008 | 27 | Yes |
Popular Name: N,N,N'-trimethyl-N'-[(3S)-1-[(3,4,5-trimethoxyphenyl)methyl]-3-piperidyl]propane-1,3-diamine N,N,N'-trimethyl-N'-[(3S)-1-[(3,…
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) | 2.09 | 6.58 | -41.09 | 1 | 6 | 1 | 39 | 380.553 | 10 | ↓ |
Lo Low (pH 4.5-6) | 2.09 | 8.86 | -109.92 | 2 | 6 | 2 | 40 | 381.561 | 10 | ↓ |