| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2010 | 15 | Yes |
Popular Name: (2S)-N1-methyl-N1-[(2-methylthiazol-4-yl)methyl]pentane-1,2-diamine (2S)-N1-methyl-N1-[(2-methylthia…
| 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) | 0.93 | 2.77 | -37.33 | 3 | 3 | 1 | 44 | 228.385 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.93 | 4.35 | -31.83 | 3 | 3 | 1 | 43 | 228.385 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.93 | 4.75 | -116.25 | 4 | 3 | 2 | 45 | 229.393 | 6 | ↓ |
