In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2009 | 20 | Yes |
Popular Name: N1-[3-(4-methoxyphenyl)cyclobutyl]-N2,N2,2-trimethyl-propane-1,2-diamine N1-[3-(4-methoxyphenyl)cyclobuty…
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) | 3.45 | 6.66 | -39.4 | 2 | 3 | 1 | 29 | 277.432 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.45 | 5.58 | -2.95 | 1 | 3 | 0 | 24 | 276.424 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.45 | 7.54 | -33.08 | 2 | 3 | 1 | 26 | 277.432 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.45 | 8.76 | -117.91 | 3 | 3 | 2 | 30 | 278.44 | 6 | ↓ |