In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 20 | Yes |
Popular Name: (1S)-N'-[(1S)-1-cyclopropylethyl]-N-ethyl-1-(3-methoxyphenyl)-N'-methyl-ethane-1,2-diamine (1S)-N'-[(1S)-1-cyclopropylethyl…
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) | 3.32 | 9.36 | -118.35 | 3 | 3 | 2 | 30 | 278.44 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.32 | 7.85 | -30.66 | 2 | 3 | 1 | 26 | 277.432 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.32 | 7.27 | -34.65 | 2 | 3 | 1 | 29 | 277.432 | 8 | ↓ |