In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2009 | 22 | Yes |
Popular Name: (4S)-1-cyclohexyl-4-(4-ethylpiperazine-1-carbonyl)pyrrolidin-2-one (4S)-1-cyclohexyl-4-(4-ethylpipe…
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) | 1.69 | 5.98 | -10.12 | 0 | 5 | 0 | 44 | 307.438 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.69 | 8.25 | -49.36 | 1 | 5 | 1 | 45 | 308.446 | 3 | ↓ |