In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 12th, 2009 | 29 | Yes |
Popular Name: (2R)-2-cyclopentyl-2-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]-N-(4-pyridylmethyl)acetamide (2R)-2-cyclopentyl-2-[4-(3,3-dim…
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) | 2.51 | 7.98 | -10.48 | 1 | 6 | 0 | 66 | 400.567 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.51 | 9.83 | -46.08 | 2 | 6 | 1 | 67 | 401.575 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.51 | 10.29 | -96.26 | 3 | 6 | 2 | 68 | 402.583 | 7 | ↓ |