In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 24th, 2010 | 22 | Yes |
Popular Name: 5-chloro-2-[(3S)-1-(1-methyl-4-piperidyl)pyrrolidin-3-yl]-1,3-benzoxazole 5-chloro-2-[(3S)-1-(1-methyl-4-p…
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) | 3.17 | 5.63 | -39.83 | 1 | 4 | 1 | 34 | 320.844 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.17 | 8.01 | -104.9 | 2 | 4 | 2 | 35 | 321.852 | 2 | ↓ |