In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2009 | 16 | Yes |
Popular Name: 5-(4-ethylpiperazin-1-yl)-1,3-dimethyl-pyrazol-4-amine 5-(4-ethylpiperazin-1-yl)-1,3-di…
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) | 0.51 | 4.63 | -40.1 | 3 | 5 | 1 | 52 | 224.332 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.51 | 2.53 | -24.35 | 3 | 5 | 1 | 52 | 224.332 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.51 | 2.42 | -4.65 | 2 | 5 | 0 | 50 | 223.324 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.51 | 4.75 | -80.13 | 4 | 5 | 2 | 53 | 225.34 | 2 | ↓ |