In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2011 | 20 | Yes |
Popular Name: 4-chloro-6-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-N,N-diethyl-1,3,5-triazin-2-amine 4-chloro-6-[(3S)-3-(dimethylamin…
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) | 3.12 | 12.75 | -41.75 | 1 | 6 | 1 | 50 | 299.83 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.12 | 10.38 | -6.44 | 0 | 6 | 0 | 48 | 298.822 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.