In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 22nd, 2008 | 21 | Yes |
Popular Name: N,N-dimethyl-N'-phenethyl-N'-(4-pyridylmethyl)ethane-1,2-diamine N,N-dimethyl-N'-phenethyl-N'-(4-…
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) | 2.29 | 9.1 | -43.97 | 1 | 3 | 1 | 21 | 284.427 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.29 | 6.57 | -4.43 | 0 | 3 | 0 | 19 | 283.419 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.29 | 9.54 | -87.56 | 2 | 3 | 2 | 22 | 285.435 | 8 | ↓ |