In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 27 | Yes |
Popular Name: (2R)-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-(4-ethylpiperazin-1-yl)propanamide (2R)-N-(1,5-dimethyl-3-oxo-2-phe…
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) | 1.13 | 6.94 | -50.07 | 2 | 7 | 1 | 64 | 372.493 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.13 | 4.68 | -26.57 | 1 | 7 | 0 | 63 | 371.485 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.13 | 7.21 | -46.41 | 2 | 7 | 1 | 64 | 372.493 | 5 | ↓ |