In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2010 | 20 | Yes |
Popular Name: 3-methyl-N-[[4-(1-piperidylmethyl)thiazol-2-yl]methyl]butanamide 3-methyl-N-[[4-(1-piperidylmethy…
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) | 2.08 | 6.57 | -39.05 | 2 | 4 | 1 | 46 | 296.46 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.08 | 4.34 | -7.75 | 1 | 4 | 0 | 45 | 295.452 | 6 | ↓ |