In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2011 | 28 | Yes |
Popular Name: (1S)-1-[(3,4-dimethoxyphenyl)methyl]-5,6,7-trimethoxy-2-methyl-3,4-dihydro-1H-isoquinoline (1S)-1-[(3,4-dimethoxyphenyl)met…
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) | 3.17 | 9.04 | -52.88 | 1 | 6 | 1 | 51 | 388.484 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.17 | 7.34 | -12.86 | 0 | 6 | 0 | 49 | 387.476 | 7 | ↓ |