In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 18 | Yes |
Popular Name: N-(2-dimethylaminoethyl)-N'-phenyl-N-propyl-ethane-1,2-diamine N-(2-dimethylaminoethyl)-N'-phen…
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) | 2.73 | 6.62 | -36.37 | 2 | 3 | 1 | 20 | 250.41 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.73 | 4.16 | -2.48 | 1 | 3 | 0 | 19 | 249.402 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.73 | 6.29 | -37.96 | 2 | 3 | 1 | 20 | 250.41 | 9 | ↓ |
Lo Low (pH 4.5-6) | 2.73 | 8.74 | -113.59 | 3 | 3 | 2 | 21 | 251.418 | 9 | ↓ |