In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 34 | Yes |
Popular Name: 5-[[[4-[[(8-hydroxy-5-quinolyl)methylamino]methyl]phenyl]methylamino]methyl]quinolin-8-ol 5-[[[4-[[(8-hydroxy-5-quinolyl)m…
None
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) | 3.84 | 6.95 | -129.28 | 6 | 6 | 2 | 99 | 452.558 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.84 | 8.49 | -161.42 | 4 | 6 | 0 | 105 | 450.542 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.84 | 6.33 | -84.26 | 4 | 6 | 0 | 98 | 450.542 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.84 | 7.72 | -140.07 | 5 | 6 | 1 | 102 | 451.55 | 8 | ↓ |