In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 15 | Yes |
Popular Name: N'-methyl-N-propyl-N'-[(1S)-1,2,2-trimethylpropyl]propane-1,3-diamine N'-methyl-N-propyl-N'-[(1S)-1,2,…
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) | 2.96 | 7.7 | -98.9 | 3 | 2 | 2 | 21 | 216.413 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.96 | 6.35 | -30.13 | 2 | 2 | 1 | 16 | 215.405 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.96 | 6.15 | -36.93 | 2 | 2 | 1 | 20 | 215.405 | 8 | ↓ |