In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 19 | No |
Popular Name: 3-methyl-1-[4-[(4S)-thiazolidine-4-carbonyl]piperazin-1-yl]butan-1-one 3-methyl-1-[4-[(4S)-thiazolidine…
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) | 0.68 | 4.69 | -50.57 | 2 | 5 | 1 | 57 | 286.421 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.68 | 3.4 | -10.21 | 1 | 5 | 0 | 53 | 285.413 | 3 | ↓ |