In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 19 | No |
Popular Name: [4-[[(2R)-tetrahydrofuran-2-yl]methyl]piperazin-1-yl]-[(4S)-thiazolidin-4-yl]methanone [4-[[(2R)-tetrahydrofuran-2-yl]m…
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) | 0.08 | 2.28 | -41.14 | 2 | 5 | 1 | 49 | 286.421 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.08 | 3.21 | -43.5 | 2 | 5 | 1 | 46 | 286.421 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.08 | 0.97 | -7.46 | 1 | 5 | 0 | 45 | 285.413 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.08 | 4.49 | -98.4 | 3 | 5 | 2 | 51 | 287.429 | 3 | ↓ |