In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 27th, 2007 | 27 | No |
Popular Name: 5-(4-fluorophenyl)-3-[2-(2-methyl-1H-indol-3-yl)ethylamino]cyclohex-2-en-1-one 5-(4-fluorophenyl)-3-[2-(2-methy…
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) | 4.71 | 11.25 | -20.03 | 2 | 3 | 0 | 45 | 362.448 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.50 | -1.05 | -50.72 | 2 | 3 | 1 | 46 | 363.456 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.24 | 10.36 | -46.7 | 1 | 3 | -1 | 51 | 361.44 | 4 | ↓ |