In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2009 | 22 | Yes |
Popular Name: 5-methyl-2-[(3S)-1-(1-methyl-4-piperidyl)pyrrolidin-3-yl]-1,3-benzoxazole 5-methyl-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) | 2.94 | 5.71 | -41.01 | 1 | 4 | 1 | 34 | 300.426 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.94 | 8.11 | -107.24 | 2 | 4 | 2 | 35 | 301.434 | 2 | ↓ |