In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2010 | 16 | Yes |
Popular Name: 2-cyano-N-[(3S)-1-isopropylpyrrolidin-3-yl]-2-methyl-propanamide 2-cyano-N-[(3S)-1-isopropylpyrro…
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) | 1.51 | 5.17 | -49.98 | 2 | 4 | 1 | 57 | 224.328 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.37 | 3.26 | -38.51 | 1 | 4 | 0 | 64 | 223.32 | 3 | ↓ |