In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: (3S)-1-(1-aminocyclohexanecarbonyl)-3-[(sulfamoylamino)methyl]piperidine (3S)-1-(1-aminocyclohexanecarbon…
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) | 0.37 | -2.06 | -58.66 | 6 | 7 | 1 | 120 | 319.451 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.37 | -2.14 | -37.22 | 4 | 7 | -1 | 121 | 317.435 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.37 | -1.8 | -16.15 | 5 | 7 | 0 | 119 | 318.443 | 4 | ↓ |