In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 16 | Yes |
Popular Name: (2R)-3-ethyl-N2-isobutyl-N2-isopropyl-pentane-1,2-diamine (2R)-3-ethyl-N2-isobutyl-N2-isop…
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) | 3.06 | 7.05 | -112.52 | 4 | 2 | 2 | 32 | 230.44 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.06 | 5.13 | -40.92 | 3 | 2 | 1 | 31 | 229.432 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.06 | 6.75 | -25.21 | 3 | 2 | 1 | 30 | 229.432 | 8 | ↓ |