In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 25th, 2008 | 18 | Yes |
Popular Name: 1-[2-(4-ethylpiperazin-1-yl)ethyl]triazole-4-carboxylic 1-[2-(4-ethylpiperazin-1-yl)ethy…
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) | -0.04 | 2.84 | -75.87 | 1 | 7 | 0 | 79 | 253.306 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.04 | 0.53 | -51.53 | 0 | 7 | -1 | 77 | 252.298 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.04 | 2.84 | -76.97 | 1 | 7 | 0 | 79 | 253.306 | 5 | ↓ |