In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 16 | No |
Popular Name: (3S)-1-cyclopropyl-N-[(3R)-1,1-dioxothiolan-3-yl]pyrrolidin-3-amine (3S)-1-cyclopropyl-N-[(3R)-1,1-d…
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) | 0.13 | 1.86 | -45.19 | 2 | 4 | 1 | 51 | 245.368 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.13 | -0.48 | -10.87 | 1 | 4 | 0 | 49 | 244.36 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.13 | 3.03 | -133.37 | 3 | 4 | 2 | 55 | 246.376 | 3 | ↓ |