In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 16th, 2008 | 19 | Yes |
Popular Name: 3-[(2-dimethylaminoethyl-methyl-amino)methyl]chromen-4-one 3-[(2-dimethylaminoethyl-methyl-…
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) | 1.58 | 6.2 | -39.8 | 1 | 4 | 1 | 38 | 261.345 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.58 | 3.71 | -11.4 | 0 | 4 | 0 | 37 | 260.337 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.58 | 6.33 | -42.2 | 1 | 4 | 1 | 38 | 261.345 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.58 | 8.52 | -109.44 | 2 | 4 | 2 | 39 | 262.353 | 5 | ↓ |