In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2010 | 20 | Yes |
Popular Name: (2R)-N1-tert-butyl-N2-(1-ethylpropyl)-N2-(2-methoxyethyl)-3-methyl-butane-1,2-diamine (2R)-N1-tert-butyl-N2-(1-ethylpr…
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) | 4.15 | 7.21 | -28.86 | 2 | 3 | 1 | 29 | 287.512 | 11 | ↓ |
Hi High (pH 8-9.5) | 4.15 | 7.17 | -0.18 | 1 | 3 | 0 | 24 | 286.504 | 11 | ↓ |
Hi High (pH 8-9.5) | 4.15 | 8.38 | -25.29 | 2 | 3 | 1 | 26 | 287.512 | 11 | ↓ |
Mid Mid (pH 6-8) | 4.15 | 8.14 | -104.84 | 3 | 3 | 2 | 30 | 288.52 | 11 | ↓ |