In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 21 | No |
Popular Name: (4R)-N-[(1R)-1-methyl-2-(o-tolyl)ethyl]isothiochroman-4-amine (4R)-N-[(1R)-1-methyl-2-(o-tolyl…
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) | 4.52 | 10.62 | -3.41 | 1 | 1 | 0 | 12 | 297.467 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.52 | 10.95 | -36.63 | 2 | 1 | 1 | 17 | 298.475 | 4 | ↓ |