In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2010 | 27 | Yes |
Popular Name: (2S)-2-acetamido-2-cyclopentyl-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)acetamide (2S)-2-acetamido-2-cyclopentyl-N…
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) | 1.42 | 7.03 | -32.86 | 2 | 7 | 0 | 85 | 370.453 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.61 | 6.42 | -80.15 | 1 | 7 | -1 | 91 | 369.445 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.