In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 30th, 2009 | 39 | Yes |
Popular Name: (3R)-1-(4-benzhydrylpiperazin-1-yl)-3-(1H-indol-3-yl)-3-(m-tolyl)propan-1-one (3R)-1-(4-benzhydrylpiperazin-1-…
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) | 6.77 | 17.52 | -12.8 | 1 | 4 | 0 | 39 | 513.685 | 7 | ↓ |
Lo Low (pH 4.5-6) | 6.77 | 19.1 | -46.92 | 2 | 4 | 1 | 41 | 514.693 | 7 | ↓ |