In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 18th, 2011 | 20 | No |
Popular Name: (2R)-2-cyclopropyl-3-[[(3R)-1,1-dioxothiolan-3-yl]-methyl-amino]-2-(ethylamino)propanamide (2R)-2-cyclopropyl-3-[[(3R)-1,1-…
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) | -0.32 | 0.19 | -59.54 | 4 | 6 | 1 | 97 | 304.436 | 7 | ↓ |
Hi High (pH 8-9.5) | -0.32 | -1.01 | -16.59 | 3 | 6 | 0 | 93 | 303.428 | 7 | ↓ |
Lo Low (pH 4.5-6) | -0.32 | -0.71 | -54.89 | 4 | 6 | 1 | 94 | 304.436 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.