In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 18 | No |
Popular Name: (4-isopentylpiperazin-1-yl)-[(4R)-thiazolidin-4-yl]methanone (4-isopentylpiperazin-1-yl)-[(4R…
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) | 1.35 | 4.02 | -40.17 | 2 | 4 | 1 | 40 | 272.438 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.35 | 5.07 | -48.78 | 2 | 4 | 1 | 37 | 272.438 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.35 | 6.26 | -101.87 | 3 | 4 | 2 | 41 | 273.446 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.35 | 2.86 | -8.92 | 1 | 4 | 0 | 36 | 271.43 | 4 | ↓ |