In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 21 | No |
Popular Name: (2S)-2-chloro-N-[5-[(3-nitrophenyl)methyl]thiazol-2-yl]propanamide (2S)-2-chloro-N-[5-[(3-nitrophen…
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) | 3.27 | 8.58 | -18.15 | 1 | 6 | 0 | 88 | 325.777 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.46 | 7.36 | -44.87 | 0 | 6 | -1 | 94 | 324.769 | 5 | ↓ |