In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 20 | Yes |
Popular Name: N-[[2-(ethylaminomethyl)phenyl]methyl]-N',N'-dimethyl-N-propyl-ethane-1,2-diamine N-[[2-(ethylaminomethyl)phenyl]m…
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) | 2.54 | 8.93 | -84.48 | 3 | 3 | 2 | 24 | 279.472 | 10 | ↓ |
Hi High (pH 8-9.5) | 2.54 | 6.45 | -36.53 | 2 | 3 | 1 | 23 | 278.464 | 10 | ↓ |
Lo Low (pH 4.5-6) | 2.54 | 10.56 | -195.49 | 4 | 3 | 3 | 25 | 280.48 | 10 | ↓ |