In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 18th, 2006 | 21 | Yes |
Popular Name: N-(2,3,4,5,6,7,8,8a-octahydro-1H-quinolizin-1-ylmethyl)-2,3-dimethyl-benzene-1,4-diamine N-(2,3,4,5,6,7,8,8a-octahydro-1H…
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) | 3.73 | 8.14 | -33.6 | 4 | 3 | 1 | 42 | 288.459 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.73 | 7.98 | -82.76 | 5 | 3 | 2 | 44 | 289.467 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.73 | 8.6 | -95.96 | 5 | 3 | 2 | 47 | 289.467 | 3 | ↓ |