In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2010 | 17 | Yes |
Popular Name: N1-(1,3-benzoxazol-2-yl)-N2,N2,2-trimethyl-propane-1,2-diamine N1-(1,3-benzoxazol-2-yl)-N2,N2,2…
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) | 2.55 | 4.28 | -38.11 | 2 | 4 | 1 | 42 | 234.323 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.55 | 2.13 | -6.4 | 1 | 4 | 0 | 41 | 233.315 | 4 | ↓ |