In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 20th, 2011 | 18 | Yes |
Popular Name: (2R)-2-cyclopropyl-2-(ethylamino)-3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide (2R)-2-cyclopropyl-2-(ethylamino…
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) | 0.20 | 4.53 | -47.31 | 4 | 6 | 1 | 90 | 270.382 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.20 | 3.43 | -13.88 | 3 | 6 | 0 | 86 | 269.374 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.