In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 18 | Yes |
Popular Name: N-[(1S)-1-(2-methoxyphenyl)ethyl]-N',N',2-trimethyl-propane-1,2-diamine N-[(1S)-1-(2-methoxyphenyl)ethyl…
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) | 2.90 | 6.05 | -33.03 | 2 | 3 | 1 | 29 | 251.394 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.90 | 6.97 | -32.38 | 2 | 3 | 1 | 26 | 251.394 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.90 | 8.08 | -114.62 | 3 | 3 | 2 | 30 | 252.402 | 6 | ↓ |