In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 3rd, 2010 | 18 | Yes |
Popular Name: 4-[[2-aminoethyl(methyl)amino]methyl]-7-hydroxy-chromen-2-one 4-[[2-aminoethyl(methyl)amino]me…
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) | 0.05 | 0.63 | -59.9 | 4 | 5 | 1 | 81 | 249.29 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.05 | 2.96 | -146.64 | 5 | 5 | 2 | 83 | 250.298 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.