In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 17 | Yes |
Popular Name: (1S)-N'-ethyl-N'-methyl-1-(4-propoxyphenyl)ethane-1,2-diamine (1S)-N'-ethyl-N'-methyl-1-(4-pro…
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) | 0.77 | 6.14 | -33.88 | 3 | 3 | 1 | 40 | 237.367 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.77 | 6.51 | -126.3 | 4 | 3 | 2 | 41 | 238.375 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.77 | 4.62 | -41.19 | 3 | 3 | 1 | 40 | 237.367 | 7 | ↓ |