In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 17 | Yes |
Popular Name: (2S,4S)-N,N-bis(2-cyanoethyl)-4-hydroxy-pyrrolidine-2-carboxamide (2S,4S)-N,N-bis(2-cyanoethyl)-4-…
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) | -2.16 | 1.17 | -58.65 | 3 | 6 | 1 | 105 | 237.283 | 5 | ↓ |
Hi High (pH 8-9.5) | -2.16 | -0.18 | -17.77 | 2 | 6 | 0 | 100 | 236.275 | 5 | ↓ |