In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 30 | Yes |
Popular Name: N-benzyl-3-[4-[3-[benzyl(methyl)amino]prop-1-ynyl]phenyl]-N-methyl-prop-2-yn-1-amine N-benzyl-3-[4-[3-[benzyl(methyl)…
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) | 5.20 | 14.01 | -7.4 | 0 | 2 | 0 | 6 | 392.546 | 6 | ↓ |
Mid Mid (pH 6-8) | 5.20 | 16.37 | -44.13 | 1 | 2 | 1 | 8 | 393.554 | 6 | ↓ |
Lo Low (pH 4.5-6) | 5.20 | 18.73 | -88.38 | 2 | 2 | 2 | 9 | 394.562 | 6 | ↓ |