In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2009 | 21 | No |
Popular Name: 4-methyl-5-[2-[4-(2-pyridyl)piperazin-1-yl]ethyl]thiazol-2-amine 4-methyl-5-[2-[4-(2-pyridyl)pipe…
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) | 1.83 | 5.55 | -33.39 | 3 | 5 | 1 | 60 | 304.443 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.83 | 6.01 | -66.7 | 4 | 5 | 2 | 61 | 305.451 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.83 | 5.23 | -9.19 | 2 | 5 | 0 | 58 | 303.435 | 4 | ↓ |