In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2010 | 12 | Yes |
Popular Name: (2S)-N1-isopropyl-N1-methyl-N2-propyl-propane-1,2-diamine (2S)-N1-isopropyl-N1-methyl-N2-p…
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) | 2.01 | 6.34 | -105.49 | 3 | 2 | 2 | 21 | 174.332 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.01 | 5.25 | -27.37 | 2 | 2 | 1 | 16 | 173.324 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.01 | 4.44 | -30.79 | 2 | 2 | 1 | 20 | 173.324 | 6 | ↓ |