In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 21 | Yes |
Popular Name: (4S)-N-[(1R)-1-(4-methylsulfanylphenyl)ethyl]chroman-4-amine (4S)-N-[(1R)-1-(4-methylsulfanyl…
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) | 3.31 | 9.02 | -44.29 | 2 | 2 | 1 | 26 | 300.447 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.31 | 8.85 | -5.78 | 1 | 2 | 0 | 21 | 299.439 | 4 | ↓ |