In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 19 | Yes |
Popular Name: [(3R)-1-[(2S)-2-aminohexanoyl]-3-piperidyl]methylurea [(3R)-1-[(2S)-2-aminohexanoyl]-3…
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) | 0.30 | 0.19 | -51.57 | 6 | 6 | 1 | 103 | 271.385 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.30 | -0.15 | -14.85 | 5 | 6 | 0 | 101 | 270.377 | 6 | ↓ |