In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 13th, 2009 | 31 | Yes |
Popular Name: N-benzyl-N-ethyl-2-[[4-(3-pyridylmethyl)piperazin-1-yl]methyl]oxazole-4-carboxamide N-benzyl-N-ethyl-2-[[4-(3-pyridy…
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) | 1.77 | 8.91 | -48.28 | 1 | 7 | 1 | 67 | 420.537 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.77 | 8.89 | -47.86 | 1 | 7 | 1 | 67 | 420.537 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.77 | 6.64 | -10.15 | 0 | 7 | 0 | 66 | 419.529 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.77 | 9.38 | -99.55 | 2 | 7 | 2 | 68 | 421.545 | 8 | ↓ |