In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 20 | Yes |
Popular Name: (1R)-N-(2-dimethylaminoethyl)-1-(2-methoxyphenyl)-N-propyl-ethane-1,2-diamine (1R)-N-(2-dimethylaminoethyl)-1-…
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) | 1.65 | 5.39 | -107.87 | 4 | 4 | 2 | 45 | 281.444 | 9 | ↓ |
Hi High (pH 8-9.5) | 1.65 | 6.89 | -100.48 | 4 | 4 | 2 | 44 | 281.444 | 9 | ↓ |
Hi High (pH 8-9.5) | 1.65 | 2.91 | -41.55 | 3 | 4 | 1 | 43 | 280.436 | 9 | ↓ |