In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 25th, 2009 | 14 | Yes |
Popular Name: N'-isopropyl-N-methyl-N-[(1S)-1-methylbutyl]propane-1,3-diamine N'-isopropyl-N-methyl-N-[(1S)-1-…
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) | 2.84 | 7.38 | -96.65 | 3 | 2 | 2 | 21 | 202.386 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.84 | 6.19 | -31.25 | 2 | 2 | 1 | 16 | 201.378 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.84 | 5.45 | -34.41 | 2 | 2 | 1 | 20 | 201.378 | 8 | ↓ |