In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 13 | Yes |
Popular Name: N-isobutyl-N-[(1S)-1-methylpropyl]propane-1,3-diamine N-isobutyl-N-[(1S)-1-methylpropy…
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) | 1.75 | 5.46 | -100.37 | 4 | 2 | 2 | 32 | 188.359 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.75 | 5.08 | -28.58 | 3 | 2 | 1 | 30 | 187.351 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.75 | 3.98 | -41.3 | 3 | 2 | 1 | 31 | 187.351 | 7 | ↓ |