In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 13th, 2011 | 21 | No |
Popular Name: (4R)-3-[4-(2-dimethylaminoethyl)piperazine-1-carbonyl]thiazolidine-4-carboxylic (4R)-3-[4-(2-dimethylaminoethyl)…
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) | -1.69 | 5.78 | -57.24 | 1 | 7 | 0 | 71 | 316.427 | 4 | ↓ |
Hi High (pH 8-9.5) | -1.69 | 3.29 | -39.56 | 0 | 7 | -1 | 70 | 315.419 | 4 | ↓ |