In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 14th, 2010 | 12 | Yes |
Popular Name: (2R)-N1-ethyl-N1-isobutyl-N2-methyl-propane-1,2-diamine (2R)-N1-ethyl-N1-isobutyl-N2-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) | 1.96 | 6.27 | -104.88 | 3 | 2 | 2 | 21 | 174.332 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.96 | 4.03 | -0.35 | 1 | 2 | 0 | 15 | 172.316 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.96 | 6.17 | -27.82 | 2 | 2 | 1 | 16 | 173.324 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.96 | 5.06 | -32.15 | 2 | 2 | 1 | 20 | 173.324 | 6 | ↓ |