In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2010 | 19 | No |
Popular Name: (2S)-N-[(3S)-1-ethyl-3-piperidyl]-2-[(Z)-N'-hydroxycarbamimidoyl]pentanamide (2S)-N-[(3S)-1-ethyl-3-piperidyl…
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) | 1.04 | 2.54 | -43.36 | 5 | 6 | 1 | 92 | 271.385 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.23 | 0.28 | -37.77 | 4 | 6 | 0 | 98 | 270.377 | 6 | ↓ |