In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2010 | 22 | Yes |
Popular Name: 2-ethyl-N-[(1S)-1-(1-prop-2-ynylbenzimidazol-2-yl)ethyl]butanamide 2-ethyl-N-[(1S)-1-(1-prop-2-ynyl…
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) | 3.33 | 8.53 | -9.21 | 1 | 4 | 0 | 47 | 297.402 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.33 | 9.28 | -29.82 | 2 | 4 | 1 | 48 | 298.41 | 6 | ↓ |