In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2009 | 27 | Yes |
Popular Name: (2S)-2-acetamido-N-[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]-3-phenyl-propanamide (2S)-2-acetamido-N-[5-(3-bromoph…
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) | 3.47 | 9.33 | -25.9 | 2 | 6 | 0 | 84 | 445.342 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.66 | 7.29 | -56.72 | 1 | 6 | -1 | 90 | 444.334 | 6 | ↓ |