In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 15th, 2011 | 21 | Yes |
Popular Name: 2-[(3S)-1-benzylpyrrolidin-3-yl]oxy-4,6-dichloro-1,3,5-triazine 2-[(3S)-1-benzylpyrrolidin-3-yl]…
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) | 3.23 | 6.68 | -40.75 | 1 | 5 | 1 | 52 | 326.207 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.23 | 4.24 | -4.05 | 0 | 5 | 0 | 51 | 325.199 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.