In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 17 | Yes |
Popular Name: (4aS,7aS)-4-(2-piperazin-1-ylethyl)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine (4aS,7aS)-4-(2-piperazin-1-yleth…
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) | 0.40 | 0.84 | -39.69 | 2 | 4 | 1 | 32 | 240.371 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.40 | 3.09 | -91.01 | 3 | 4 | 2 | 34 | 241.379 | 3 | ↓ |