In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2005 | 28 | Yes |
Popular Name: 1-(1-adamantyl)-4-(5-chloro-2-methoxy-phenyl)sulfonyl-piperazine 1-(1-adamantyl)-4-(5-chloro-2-me…
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) | 4.73 | 8.97 | -44.72 | 1 | 5 | 1 | 51 | 426.002 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.73 | 6.95 | -9.36 | 0 | 5 | 0 | 50 | 424.994 | 4 | ↓ |