In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 31st, 2009 | 19 | Yes |
Popular Name: [(2S)-2-methyl-1-piperidyl]-[2-[(2S)-pyrrolidin-2-yl]thiazol-4-yl]methanone [(2S)-2-methyl-1-piperidyl]-[2-[…
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) | 1.66 | 5.7 | -47.67 | 2 | 4 | 1 | 50 | 280.417 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.66 | 4.46 | -7.14 | 1 | 4 | 0 | 45 | 279.409 | 2 | ↓ |