In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 17 | Yes |
Popular Name: (2R)-N2-ethyl-N1-isobutyl-N1-isopropyl-3,3-dimethyl-butane-1,2-diamine (2R)-N2-ethyl-N1-isobutyl-N1-iso…
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) | 3.99 | 8.91 | -104.61 | 3 | 2 | 2 | 21 | 244.467 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.99 | 8.86 | -30.5 | 2 | 2 | 1 | 20 | 243.459 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.99 | 8.38 | -29.58 | 2 | 2 | 1 | 16 | 243.459 | 8 | ↓ |