In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 4th, 2004 | 27 | No |
Popular Name: (3R)-3-(4-fluoroanilino)-1-(4-piperidinophenyl)pyrrolidine-2,5-quinone (3R)-3-(4-fluoroanilino)-1-(4-pi…
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) | 3.66 | 9.38 | -13.4 | 1 | 5 | 0 | 53 | 367.424 | 4 | ↓ |
Ref Reference (pH 7) | 3.66 | 9.43 | -13.65 | 1 | 5 | 0 | 53 | 367.424 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.66 | 10.05 | -40.64 | 2 | 5 | 1 | 54 | 368.432 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.66 | 10.05 | -40.6 | 2 | 5 | 1 | 54 | 368.432 | 4 | ↓ |