In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 15 | No |
Popular Name: (1R)-1-(1,3-benzoxazol-2-yl)-3-methylsulfanyl-propan-1-amine (1R)-1-(1,3-benzoxazol-2-yl)-3-m…
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) | 0.25 | 2.29 | -47.69 | 3 | 3 | 1 | 54 | 223.321 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.25 | 1.96 | -8.86 | 2 | 3 | 0 | 52 | 222.313 | 4 | ↓ |