In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 18 | Yes |
Popular Name: 4-[(2S)-2-aminopentanoyl]-N,N-dimethyl-piperazine-1-carboxamide 4-[(2S)-2-aminopentanoyl]-N,N-di…
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) | -0.64 | 2.31 | -50.07 | 3 | 6 | 1 | 71 | 257.358 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.64 | 1.97 | -12.26 | 2 | 6 | 0 | 70 | 256.35 | 3 | ↓ |