In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2009 | 21 | Yes |
Popular Name: 2-[(3S)-1-(1H-imidazol-2-ylmethyl)pyrrolidin-3-yl]-5-methyl-1,3-benzoxazole 2-[(3S)-1-(1H-imidazol-2-ylmethy…
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) | 2.02 | 3.96 | -35.86 | 2 | 5 | 1 | 59 | 283.355 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.02 | 3.03 | -12.01 | 1 | 5 | 0 | 58 | 282.347 | 3 | ↓ |