In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2005 | 35 | Yes |
Popular Name: [3-(9-cyclohexylamino-4-methyl-1,7-diazabicyclo[4.3.0]nona-2,4,6,8-tetraen-8-yl)phenyl] [3-(9-cyclohexylamino-4-methyl-1…
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) | 6.94 | 17.54 | -30.46 | 2 | 6 | 1 | 66 | 491.011 | 8 | ↓ |
Mid Mid (pH 6-8) | 6.94 | 17.12 | -19.11 | 1 | 6 | 0 | 65 | 490.003 | 8 | ↓ |