In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 13th, 2009 | 30 | Yes |
Popular Name: N-benzyl-N-methyl-2-[[4-(3-pyridylmethyl)piperazin-1-yl]methyl]oxazole-4-carboxamide N-benzyl-N-methyl-2-[[4-(3-pyrid…
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) | 1.40 | 7.45 | -48.17 | 1 | 7 | 1 | 67 | 406.51 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.40 | 7.43 | -48.14 | 1 | 7 | 1 | 67 | 406.51 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.40 | 5.18 | -10.68 | 0 | 7 | 0 | 66 | 405.502 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.40 | 7.91 | -99.08 | 2 | 7 | 2 | 68 | 407.518 | 7 | ↓ |