In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 30th, 2008 | 29 | Yes |
Popular Name: N-(3-amino-3-oxo-propyl)-2-[(4-cinnamylpiperazin-1-yl)methyl]oxazole-4-carboxamide N-(3-amino-3-oxo-propyl)-2-[(4-c…
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) | 0.95 | 1.74 | -61.06 | 4 | 8 | 1 | 106 | 398.487 | 9 | ↓ |
Mid Mid (pH 6-8) | 0.95 | 1.68 | -59.32 | 4 | 8 | 1 | 106 | 398.487 | 9 | ↓ |
Mid Mid (pH 6-8) | 0.95 | -0.64 | -19.67 | 3 | 8 | 0 | 105 | 397.479 | 9 | ↓ |