In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2009 | 21 | Yes |
Popular Name: 6-[(R)-(3-methoxyphenyl)-(methylamino)methyl]-3H-1,3-benzoxazol-2-one 6-[(R)-(3-methoxyphenyl)-(methyl…
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) | 2.52 | 4.82 | -56.92 | 3 | 5 | 1 | 72 | 285.323 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.98 | 1.2 | -48.7 | 1 | 5 | -1 | 70 | 283.307 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.98 | 2.2 | -76.44 | 2 | 5 | 0 | 75 | 284.315 | 4 | ↓ |