| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 20 | No |
Popular Name: N2,N2,2-trimethyl-N1-[(1S)-1-(3-nitrophenyl)propyl]propane-1,2-diamine N2,N2,2-trimethyl-N1-[(1S)-1-(3-…
| 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) | 2.43 | 7.69 | -45.66 | 2 | 5 | 1 | 66 | 280.392 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.43 | 6.1 | -4.97 | 1 | 5 | 0 | 61 | 279.384 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.43 | 9.75 | -127.85 | 3 | 5 | 2 | 67 | 281.4 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.43 | 8.6 | -41.73 | 2 | 5 | 1 | 62 | 280.392 | 7 | ↓ |
