In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 22nd, 2008 | 26 | No |
Popular Name: (2S)-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(2,5-dioxopyrrolidin-1-yl)phenyl]propanamide (2S)-N-(5-cyclopropyl-1H-pyrazol…
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) | 1.03 | 7.84 | -20.4 | 2 | 7 | 0 | 95 | 352.394 | 5 | ↓ |
Ref Reference (pH 7) | 2.88 | 3.6 | -16.36 | 4 | 7 | 0 | 103 | 352.394 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.88 | 4.38 | -62.59 | 3 | 7 | -1 | 106 | 351.386 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.88 | 4.44 | -60.99 | 3 | 7 | -1 | 106 | 351.386 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.88 | 3.66 | -14.58 | 4 | 7 | 0 | 103 | 352.394 | 5 | ↓ |