In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 17 | No |
Popular Name: 4-(chloromethyl)-2-[(4-isopropylpiperazin-1-yl)methyl]thiazole 4-(chloromethyl)-2-[(4-isopropyl…
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) | 1.78 | 5.4 | -35.65 | 1 | 3 | 1 | 21 | 274.841 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.78 | 5.23 | -35.89 | 1 | 3 | 1 | 21 | 274.841 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.78 | 2.98 | -5.02 | 0 | 3 | 0 | 19 | 273.833 | 4 | ↓ |