In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2011 | 21 | No |
Popular Name: 2-[(2S)-2-ethylpyrrolidin-1-yl]-N'-hydroxy-quinoline-3-carboxamidine 2-[(2S)-2-ethylpyrrolidin-1-yl]-…
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) | 1.90 | 6.83 | -8.72 | 3 | 5 | 0 | 75 | 284.363 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.90 | 7.26 | -25.54 | 4 | 5 | 1 | 76 | 285.371 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.