In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 21 | Yes |
Popular Name: (1S)-1-[[(1R)-1-(4-methylsulfanylphenyl)ethyl]amino]indan-4-ol (1S)-1-[[(1R)-1-(4-methylsulfany…
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) | 4.27 | 7.92 | -45.69 | 3 | 2 | 1 | 37 | 300.447 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.27 | 6.94 | -6.43 | 2 | 2 | 0 | 32 | 299.439 | 4 | ↓ |