In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 23rd, 2009 | 17 | Yes |
Popular Name: (3S)-1-[(2S,3S)-2-amino-3-methyl-pentanoyl]piperidine-3-carboxamide (3S)-1-[(2S,3S)-2-amino-3-methyl…
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) | -0.34 | 0.18 | -50.08 | 5 | 5 | 1 | 91 | 242.343 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.34 | -0.1 | -13.81 | 4 | 5 | 0 | 89 | 241.335 | 4 | ↓ |