In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 20 | No |
Popular Name: 2-[[(3R)-1-methylpyrrolidin-3-yl]amino]-5,6,7,8-tetrahydroquinoline-3-carbothioamide 2-[[(3R)-1-methylpyrrolidin-3-yl…
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) | 2.19 | 7.04 | -44.08 | 4 | 4 | 1 | 55 | 291.444 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.19 | 7.3 | -97.78 | 5 | 4 | 2 | 57 | 292.452 | 3 | ↓ |