In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 19 | Yes |
Popular Name: 6-[(R)-amino(o-tolyl)methyl]-3H-1,3-benzoxazol-2-one 6-[(R)-amino(o-tolyl)methyl]-3H-…
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 | 4.15 | -60.91 | 4 | 4 | 1 | 74 | 255.297 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.97 | 1.17 | -48.35 | 2 | 4 | -1 | 75 | 253.281 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.97 | 1.51 | -80.16 | 3 | 4 | 0 | 77 | 254.289 | 2 | ↓ |