In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2005 | 36 | No |
Popular Name: [4-(9-cyclohexylamino-1,7-diazabicyclo[4.3.0]nona-2,4,6,8-tetraen-8-yl)-2-methoxy-phenyl] [4-(9-cyclohexylamino-1,7-diazab…
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) | 6.28 | 1.55 | -16.4 | 1 | 9 | 0 | 110 | 486.528 | 8 | ↓ |
Mid Mid (pH 6-8) | 6.28 | 1.69 | -37.4 | 2 | 9 | 1 | 111 | 487.536 | 8 | ↓ |