In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 20th, 2011 | 21 | Yes |
Popular Name: (2S)-2-amino-2-cyclopropyl-3-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]propanamide (2S)-2-amino-2-cyclopropyl-3-[(4…
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) | 0.27 | 4.35 | -55.78 | 5 | 6 | 1 | 101 | 308.431 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.27 | 4.02 | -18.41 | 4 | 6 | 0 | 100 | 307.423 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.