In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 28th, 2010 | 14 | Yes |
Popular Name: N'-[(1S)-1,2-dimethylpropyl]-N'-methyl-N-propyl-propane-1,3-diamine N'-[(1S)-1,2-dimethylpropyl]-N'-…
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) | 2.38 | 7.47 | -98.85 | 3 | 2 | 2 | 21 | 202.386 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.38 | 6.13 | -30.76 | 2 | 2 | 1 | 16 | 201.378 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.38 | 5.62 | -36.32 | 2 | 2 | 1 | 20 | 201.378 | 8 | ↓ |