In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: (2R)-N2-(1-ethylpropyl)-4-(4-methoxyphenyl)-N2,2-dimethyl-butane-1,2-diamine (2R)-N2-(1-ethylpropyl)-4-(4-met…
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) | 3.70 | 6.12 | -45.25 | 3 | 3 | 1 | 40 | 293.475 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.70 | 6.9 | -31.75 | 3 | 3 | 1 | 40 | 293.475 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.70 | 7.23 | -122.48 | 4 | 3 | 2 | 41 | 294.483 | 9 | ↓ |