In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2009 | 19 | Yes |
Popular Name: (3S)-3-ethyl-4-[[(3S)-1,2,3,4-tetrahydroisoquinolin-3-yl]methyl]morpholine (3S)-3-ethyl-4-[[(3S)-1,2,3,4-te…
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) | 2.22 | 6.17 | -36.64 | 2 | 3 | 1 | 26 | 261.389 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.22 | 4.44 | -3.1 | 1 | 3 | 0 | 24 | 260.381 | 3 | ↓ |