In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2010 | 16 | No |
Popular Name: (2R)-3-amino-N-[(3R)-1-cyclopropylpyrrolidin-3-yl]-2-methyl-3-thioxo-propanamide (2R)-3-amino-N-[(3R)-1-cycloprop…
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) | -0.40 | 3.42 | -49.18 | 4 | 4 | 1 | 60 | 242.368 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.22 | 1.47 | -41.5 | 3 | 4 | 0 | 66 | 241.36 | 4 | ↓ |