| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2008 | 22 | Yes |
Popular Name: (2S)-1-[(2S)-2-amino-3-methyl-butanoyl]-N-(cyclohexylmethyl)pyrrolidine-2-carboxamide (2S)-1-[(2S)-2-amino-3-methyl-bu…
| 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) | 1.43 | 5.81 | -46.04 | 4 | 5 | 1 | 77 | 310.462 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.43 | 5.52 | -13.59 | 3 | 5 | 0 | 75 | 309.454 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
