In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 18 | No |
Popular Name: 2-[[(1S)-1,2-dimethylpropyl]amino]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbothioamide 2-[[(1S)-1,2-dimethylpropyl]amin…
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) | 2.98 | 6.62 | -11.09 | 3 | 3 | 0 | 51 | 263.41 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.98 | 6.93 | -33.91 | 4 | 3 | 1 | 52 | 264.418 | 4 | ↓ |