In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 2nd, 2010 | 21 | Yes |
Popular Name: N-methyl-2-phenyl-N-[[(1S)-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]ethanamine N-methyl-2-phenyl-N-[[(1S)-1,2,3…
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) | 3.51 | 9.92 | -41.31 | 2 | 2 | 1 | 16 | 281.423 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.51 | 7.85 | -3.43 | 1 | 2 | 0 | 15 | 280.415 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.51 | 11.19 | -129.63 | 3 | 2 | 2 | 21 | 282.431 | 5 | ↓ |