In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 24 | Yes |
Popular Name: 8-(cyclohexylamino)-7-[(2S)-2,3-dihydroxypropyl]-3-methyl-xanthine 8-(cyclohexylamino)-7-[(2S)-2,3-…
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) | -0.14 | -7.57 | -13.04 | 4 | 9 | 0 | 125 | 337.38 | 5 | ↓ |