In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2009 | 21 | Yes |
Popular Name: (2R)-N1-[3-(4-methoxyphenyl)cyclobutyl]-N2,N2,3-trimethyl-butane-1,2-diamine (2R)-N1-[3-(4-methoxyphenyl)cycl…
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) | 3.75 | 7.12 | -40.29 | 2 | 3 | 1 | 29 | 291.459 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.75 | 9.38 | -33.87 | 2 | 3 | 1 | 26 | 291.459 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.75 | 9.68 | -120.69 | 3 | 3 | 2 | 30 | 292.467 | 7 | ↓ |