In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 18 | No |
Popular Name: 2-[[(3R)-1-cyclopropylpyrrolidin-3-yl]amino]pyridine-3-carbothioamide 2-[[(3R)-1-cyclopropylpyrrolidin…
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) | 1.16 | 6.03 | -41.29 | 4 | 4 | 1 | 55 | 263.39 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.16 | 6.37 | -101.24 | 5 | 4 | 2 | 57 | 264.398 | 4 | ↓ |