In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 21 | Yes |
Popular Name: (3R)-1-cyclopropyl-N-[(4S)-1,1-dioxo-3,4-dihydro-2H-thiochromen-4-yl]pyrrolidin-3-amine (3R)-1-cyclopropyl-N-[(4S)-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) | 0.68 | 4.7 | -50.92 | 2 | 4 | 1 | 51 | 307.439 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.68 | 2.37 | -12.26 | 1 | 4 | 0 | 49 | 306.431 | 3 | ↓ |