In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 18 | Yes |
Popular Name: (2R,3aS,7aS)-2-[(4-methoxy-1-piperidyl)methyl]-2,3,3a,4,5,6,7,7a-octahydro-1H-indole (2R,3aS,7aS)-2-[(4-methoxy-1-pip…
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) | 2.56 | 7.12 | -117.7 | 3 | 3 | 2 | 30 | 254.418 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.56 | 5.18 | -32.76 | 2 | 3 | 1 | 29 | 253.41 | 3 | ↓ |