In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 12th, 2009 | 18 | Yes |
Popular Name: (3S)-3-methyl-4-[[(3S)-1,2,3,4-tetrahydroisoquinolin-3-yl]methyl]morpholine (3S)-3-methyl-4-[[(3S)-1,2,3,4-t…
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) | 1.68 | 5.53 | -36.35 | 2 | 3 | 1 | 26 | 247.362 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.68 | 3.79 | -3.25 | 1 | 3 | 0 | 24 | 246.354 | 2 | ↓ |