In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 13 | No |
Popular Name: 1-methyl-4-[[(4R)-thiazolidin-4-yl]methyl]piperazine 1-methyl-4-[[(4R)-thiazolidin-4-…
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) | 0.38 | 2.01 | -38.35 | 2 | 3 | 1 | 20 | 202.347 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.38 | -0.21 | -2.82 | 1 | 3 | 0 | 19 | 201.339 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.38 | 2.26 | -37.81 | 2 | 3 | 1 | 20 | 202.347 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.38 | 3.57 | -96.59 | 3 | 3 | 2 | 24 | 203.355 | 2 | ↓ |