In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2010 | 15 | Yes |
Popular Name: (2R)-1-(4-ethylpiperazin-1-yl)-3,3-dimethyl-butan-2-ol (2R)-1-(4-ethylpiperazin-1-yl)-3…
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) | 1.67 | 3.01 | -31.62 | 2 | 3 | 1 | 28 | 215.361 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.67 | 0.73 | -2.35 | 1 | 3 | 0 | 27 | 214.353 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.67 | 3.04 | -33.08 | 2 | 3 | 1 | 28 | 215.361 | 4 | ↓ |