In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 20 | No |
Popular Name: 2-[[(1S)-1-(4-chlorophenyl)ethyl]amino]-6-methyl-pyridine-3-carbothioamide 2-[[(1S)-1-(4-chlorophenyl)ethyl…
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) | 3.34 | 7.75 | -11.91 | 3 | 3 | 0 | 51 | 305.834 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.34 | 8.05 | -42.87 | 4 | 3 | 1 | 52 | 306.842 | 4 | ↓ |