In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2009 | 29 | Yes |
Popular Name: (2S)-1-(3,5-dichlorobenzoyl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2-carboxamide (2S)-1-(3,5-dichlorobenzoyl)-N-(…
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) | 4.02 | 10.28 | -24.82 | 1 | 6 | 0 | 75 | 447.347 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.20 | 8.26 | -58.78 | 0 | 6 | -1 | 82 | 446.339 | 4 | ↓ |