In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2009 | 30 | Yes |
Popular Name: (2S)-N-[5-(m-tolyl)-1,3,4-thiadiazol-2-yl]-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide (2S)-N-[5-(m-tolyl)-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) | 3.95 | 8.64 | -30.43 | 1 | 7 | 0 | 92 | 442.566 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.14 | 6.73 | -50.12 | 0 | 7 | -1 | 99 | 441.558 | 5 | ↓ |