In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 20 | Yes |
Popular Name: N-benzyl-2-[[(3S)-1-isopropylpyrrolidin-3-yl]amino]acetamide N-benzyl-2-[[(3S)-1-isopropylpyr…
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) | 1.93 | 5.43 | -35.4 | 3 | 4 | 1 | 46 | 276.404 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.93 | 3.01 | -7.46 | 2 | 4 | 0 | 44 | 275.396 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.93 | 4.22 | -41.54 | 3 | 4 | 1 | 49 | 276.404 | 6 | ↓ |