In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2010 | 16 | Yes |
Popular Name: N'-[(1S)-1,3-dimethylbutyl]-N'-methyl-N-[(1S)-1-methylbutyl]ethane-1,2-diamine N'-[(1S)-1,3-dimethylbutyl]-N'-m…
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) | 3.88 | 8.7 | -109.89 | 3 | 2 | 2 | 21 | 230.44 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.88 | 7.53 | -31.59 | 2 | 2 | 1 | 16 | 229.432 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.88 | 6.81 | -34.77 | 2 | 2 | 1 | 20 | 229.432 | 9 | ↓ |