In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 17 | Yes |
Popular Name: (2S,4S)-2-ethyl-N2-isopentyl-N2,4-dimethyl-hexane-1,2-diamine (2S,4S)-2-ethyl-N2-isopentyl-N2,…
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) | 3.63 | 7.17 | -119.36 | 4 | 2 | 2 | 32 | 244.467 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.63 | 5.18 | -41.69 | 3 | 2 | 1 | 31 | 243.459 | 9 | ↓ |