In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 20 | Yes |
Popular Name: 4-[[2-(aminomethyl)phenyl]methyl-ethyl-amino]-N,N-dimethyl-butanamide 4-[[2-(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) | 0.70 | 6.84 | -116.3 | 4 | 4 | 2 | 52 | 279.428 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.70 | 6.54 | -37.78 | 3 | 4 | 1 | 51 | 278.42 | 8 | ↓ |