In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 22 | No |
Popular Name: (2S)-N-[5-[(4-butylphenyl)methyl]thiazol-2-yl]-2-chloro-propanamide (2S)-N-[5-[(4-butylphenyl)methyl…
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) | 5.20 | 10.86 | -13.23 | 1 | 3 | 0 | 42 | 336.888 | 7 | ↓ |
Hi High (pH 8-9.5) | 5.39 | 9.64 | -41.9 | 0 | 3 | -1 | 48 | 335.88 | 7 | ↓ |