In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 36 | No |
Popular Name: imino-methyl-oxo-[(1R)-1-phenylethyl]-N-[2-(1-piperidyl)ethyl]BLAHcarboxamide imino-methyl-oxo-[(1R)-1-phenyle…
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) | 0.03 | 14.87 | -77.71 | 4 | 8 | 2 | 98 | 486.62 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.10 | 13.86 | -48.76 | 3 | 8 | 1 | 104 | 485.612 | 6 | ↓ |