In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 2nd, 2006 | 24 | Yes |
Popular Name: 4-[7-(m-tolylamino)-2,6,9-triazabicyclo[4.3.0]nona-2,4,7,9-tetraen-8-yl]phenol 4-[7-(m-tolylamino)-2,6,9-triaza…
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) | 4.11 | 10.15 | -14.31 | 2 | 5 | 0 | 62 | 316.364 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.11 | 10.48 | -28.52 | 3 | 5 | 1 | 64 | 317.372 | 3 | ↓ |