In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 19 | Yes |
Popular Name: 2-[(4aS,8aS)-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl]benzamidine 2-[(4aS,8aS)-2,3,4a,5,6,7,8,8a-o…
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) | 1.61 | 5.02 | -31.3 | 4 | 4 | 1 | 64 | 260.361 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.61 | 5.07 | -4.9 | 3 | 4 | 0 | 62 | 259.353 | 2 | ↓ |