In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 21 | Yes |
Popular Name: (1S,2R)-N1-(2-dimethylaminoethyl)-1-(3-methoxyphenyl)-N1-propyl-propane-1,2-diamine (1S,2R)-N1-(2-dimethylaminoethyl…
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) | 2.07 | 5.56 | -100.48 | 4 | 4 | 2 | 45 | 295.471 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.07 | 3.08 | -41.94 | 3 | 4 | 1 | 43 | 294.463 | 9 | ↓ |