In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 18 | No |
Popular Name: 5-[(4aS,8aS)-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl]-N'-hydroxy-pentanamidine 5-[(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) | 1.64 | 3.46 | -39.83 | 4 | 5 | 1 | 72 | 256.37 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 1.26 | -7.44 | 3 | 5 | 0 | 71 | 255.362 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.64 | 3.41 | -88.53 | 5 | 5 | 2 | 74 | 257.378 | 5 | ↓ |