In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 17 | Yes |
Popular Name: N'-isobutyl-N-methyl-N-(o-tolylmethyl)ethane-1,2-diamine N'-isobutyl-N-methyl-N-(o-tolylm…
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) | 2.70 | 9.23 | -117.72 | 3 | 2 | 2 | 21 | 236.403 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.70 | 7.88 | -34.48 | 2 | 2 | 1 | 16 | 235.395 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.70 | 7.25 | -39.24 | 2 | 2 | 1 | 20 | 235.395 | 7 | ↓ |