In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 16th, 2010 | 17 | Yes |
Popular Name: 3-(methylamino)-1-(4-thiazol-2-ylpiperazin-1-yl)propan-1-one 3-(methylamino)-1-(4-thiazol-2-y…
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) | 0.36 | 4.24 | -48.62 | 2 | 5 | 1 | 53 | 255.367 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.36 | 4.69 | -86.6 | 3 | 5 | 2 | 54 | 256.375 | 4 | ↓ |