In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 26th, 2011 | 24 | Yes |
Popular Name: (2R)-N-(1,3-benzothiazol-2-ylmethyl)-2-(4-cyano-1-piperidyl)-N-methyl-propanamide (2R)-N-(1,3-benzothiazol-2-ylmet…
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) | 2.15 | 9.13 | -52.89 | 1 | 5 | 1 | 61 | 343.476 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.15 | 6.73 | -13.86 | 0 | 5 | 0 | 60 | 342.468 | 4 | ↓ |