In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 16th, 2008 | 33 | Yes |
Popular Name: 3-[3-[4-[(S)-(4-methoxyphenyl)-phenyl-methyl]piperazin-1-yl]propyl]-1H-indole 3-[3-[4-[(S)-(4-methoxyphenyl)-p…
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) | 5.94 | 14.43 | -44.74 | 2 | 4 | 1 | 33 | 440.611 | 8 | ↓ |
Mid Mid (pH 6-8) | 5.94 | 13.87 | -39.05 | 2 | 4 | 1 | 33 | 440.611 | 8 | ↓ |
Mid Mid (pH 6-8) | 5.94 | 12.06 | -8.69 | 1 | 4 | 0 | 32 | 439.603 | 8 | ↓ |