In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 18 | Yes |
Popular Name: N-[[4-(aminomethyl)phenyl]methyl]-2-methoxy-N-(2-methoxyethyl)ethanamine N-[[4-(aminomethyl)phenyl]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) | 0.89 | 4.39 | -85.6 | 4 | 4 | 2 | 51 | 254.374 | 9 | ↓ |
Hi High (pH 8-9.5) | 0.89 | 4 | -31.52 | 3 | 4 | 1 | 49 | 253.366 | 9 | ↓ |
Hi High (pH 8-9.5) | 0.89 | 1.97 | -45.34 | 3 | 4 | 1 | 49 | 253.366 | 9 | ↓ |
Hi High (pH 8-9.5) | 0.89 | 2.38 | -3.49 | 2 | 4 | 0 | 48 | 252.358 | 9 | ↓ |