In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 17 | Yes |
Popular Name: (2S)-N1,N2-dipropyl-N2-(2,2,2-trifluoroethyl)butane-1,2-diamine (2S)-N1,N2-dipropyl-N2-(2,2,2-tr…
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) | 3.33 | 6.33 | -37.86 | 2 | 2 | 1 | 20 | 255.348 | 10 | ↓ |
Hi High (pH 8-9.5) | 3.33 | 4.61 | -2.33 | 1 | 2 | 0 | 15 | 254.34 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.33 | 7.88 | -116.52 | 3 | 2 | 2 | 21 | 256.356 | 10 | ↓ |