In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2009 | 21 | Yes |
Popular Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine N-[(6-chloro-3,4-dihydro-2H-1,5-…
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) | 2.53 | 5.04 | -8.72 | 2 | 5 | 0 | 59 | 307.781 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.53 | 5.18 | -34.33 | 3 | 5 | 1 | 60 | 308.789 | 3 | ↓ |