In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2005 | 34 | Yes |
Popular Name: [3-(3-bromo-9-cyclohexylamino-1,7-diazabicyclo[4.3.0]nona-2,4,6,8-tetraen-8-yl)phenyl] [3-(3-bromo-9-cyclohexylamino-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) | 7.50 | 0.49 | -15.81 | 1 | 6 | 0 | 64 | 520.427 | 7 | ↓ |
Mid Mid (pH 6-8) | 7.50 | 0.67 | -28.87 | 2 | 6 | 1 | 66 | 521.435 | 7 | ↓ |