In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 28th, 2010 | 13 | Yes |
Popular Name: N'-[(1R)-1,2-dimethylpropyl]-N-ethyl-N'-methyl-propane-1,3-diamine N'-[(1R)-1,2-dimethylpropyl]-N-e…
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) | 1.88 | 6.72 | -96.95 | 3 | 2 | 2 | 21 | 188.359 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.88 | 5.34 | -30.55 | 2 | 2 | 1 | 16 | 187.351 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.88 | 4.74 | -35.07 | 2 | 2 | 1 | 20 | 187.351 | 7 | ↓ |