| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 21 | Yes |
Popular Name: (2S)-2-amino-4-methyl-1-[4-[(2-methylthiazol-4-yl)methyl]piperazin-1-yl]pentan-1-one (2S)-2-amino-4-methyl-1-[4-[(2-m…
| 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) | 0.35 | 2.68 | -46.03 | 3 | 5 | 1 | 64 | 311.475 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.35 | 2.34 | -9.67 | 2 | 5 | 0 | 62 | 310.467 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.35 | 4.9 | -103.23 | 4 | 5 | 2 | 65 | 312.483 | 5 | ↓ |
