| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 21 | No |
Popular Name: (2S)-N2,N2,3-trimethyl-N1-[(1R)-1-(3-nitrophenyl)propyl]butane-1,2-diamine (2S)-N2,N2,3-trimethyl-N1-[(1R)-…
| 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) | 2.73 | 8.19 | -45.88 | 2 | 5 | 1 | 66 | 294.419 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.73 | 9.84 | -134.82 | 3 | 5 | 2 | 67 | 295.427 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.73 | 10.53 | -42.32 | 2 | 5 | 1 | 62 | 294.419 | 8 | ↓ |
