In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 19 | Yes |
Popular Name: N-[[5-(4-ethylpiperazin-1-yl)-1,3-dimethyl-pyrazol-4-yl]methyl]ethanamine N-[[5-(4-ethylpiperazin-1-yl)-1,…
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) | 0.97 | 7.41 | -97.81 | 3 | 5 | 2 | 42 | 267.421 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.97 | 3.79 | -3.99 | 1 | 5 | 0 | 36 | 265.405 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.97 | 5.17 | -37.85 | 2 | 5 | 1 | 41 | 266.413 | 5 | ↓ |