In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2005 | 34 | Yes |
Popular Name: [2-(7-benzylamino-4-bromo-6,9-diazabicyclo[4.3.0]nona-2,4,7,9-tetraen-8-yl)phenyl] [2-(7-benzylamino-4-bromo-6,9-di…
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) | 7.10 | 16.86 | -12.19 | 1 | 5 | 0 | 56 | 516.37 | 7 | ↓ |
Lo Low (pH 4.5-6) | 7.10 | 17.18 | -28.49 | 2 | 5 | 1 | 57 | 517.378 | 7 | ↓ |