In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2010 | 28 | Yes |
Popular Name: (3S)-N-[5-(2-furyl)-1,3,4-thiadiazol-2-yl]-1-(4-methylbenzoyl)piperidine-3-carboxamide (3S)-N-[5-(2-furyl)-1,3,4-thiadi…
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) | 2.71 | 8.44 | -17.58 | 1 | 7 | 0 | 88 | 396.472 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.89 | 6.88 | -56.62 | 0 | 7 | -1 | 95 | 395.464 | 4 | ↓ |