In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 20 | Yes |
Popular Name: (3R)-1-[2-[[(1R)-1-methylpropyl]amino]acetyl]-3-[(sulfamoylamino)methyl]piperidine (3R)-1-[2-[[(1R)-1-methylpropyl]…
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) | -0.02 | -0.55 | -48.21 | 5 | 7 | 1 | 109 | 307.44 | 7 | ↓ |
Hi High (pH 8-9.5) | -0.02 | -0.93 | -64.85 | 4 | 7 | 0 | 111 | 306.432 | 7 | ↓ |
Hi High (pH 8-9.5) | -0.02 | -1.62 | -16.54 | 4 | 7 | 0 | 105 | 306.432 | 7 | ↓ |