In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 11th, 2009 | 25 | Yes |
Popular Name: (2S)-N-[(1S)-1-[(1-carbamoylcyclohexyl)carbamoyl]-3-methyl-butyl]pyrrolidine-2-carboxamide (2S)-N-[(1S)-1-[(1-carbamoylcycl…
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) | 1.05 | 1.89 | -49.55 | 6 | 7 | 1 | 118 | 353.487 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.05 | 0.66 | -18.27 | 5 | 7 | 0 | 113 | 352.479 | 7 | ↓ |