In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 19 | No |
Popular Name: 2-(dimethylamino)-1-[4-[(4R)-thiazolidine-4-carbonyl]piperazin-1-yl]ethanone 2-(dimethylamino)-1-[4-[(4R)-thi…
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) | -0.95 | 4.03 | -91.43 | 3 | 6 | 2 | 62 | 288.417 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.95 | 0.49 | -13.58 | 1 | 6 | 0 | 56 | 286.401 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.95 | 2.89 | -46.96 | 2 | 6 | 1 | 57 | 287.409 | 3 | ↓ |