In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 22 | Yes |
Popular Name: (2R)-6-[2-(aminomethyl)thiazol-4-yl]-2-methyl-4-propyl-1,4-benzoxazin-3-one (2R)-6-[2-(aminomethyl)thiazol-4…
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) | 1.97 | 4.82 | -55.19 | 3 | 5 | 1 | 70 | 318.422 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.97 | 4.43 | -9.53 | 2 | 5 | 0 | 68 | 317.414 | 4 | ↓ |