In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2010 | 28 | Yes |
Popular Name: (3S)-N-butyl-1-[3-oxo-3-[[(1R)-tetralin-1-yl]amino]propyl]piperidine-3-carboxamide (3S)-N-butyl-1-[3-oxo-3-[[(1R)-t…
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) | 2.50 | 9.66 | -47.4 | 3 | 5 | 1 | 63 | 386.56 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.50 | 7.44 | -15.33 | 2 | 5 | 0 | 61 | 385.552 | 8 | ↓ |