| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 16 | Yes |
Popular Name: (2S)-N',N',3-trimethyl-N-[(2-methylthiazol-4-yl)methyl]butane-1,2-diamine (2S)-N',N',3-trimethyl-N-[(2-met…
| 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) | 1.52 | 5.82 | -31.73 | 2 | 3 | 1 | 29 | 242.412 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.52 | 3.8 | -4.36 | 1 | 3 | 0 | 28 | 241.404 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.52 | 4.48 | -36.89 | 2 | 3 | 1 | 33 | 242.412 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.52 | 6.48 | -108.84 | 3 | 3 | 2 | 34 | 243.42 | 6 | ↓ |
