In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2008 | 19 | Yes |
Popular Name: 3-chloro-4-[(4-methyl-1,4-diazepan-1-yl)sulfonyl]aniline 3-chloro-4-[(4-methyl-1,4-diazep…
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) | 1.10 | 3.19 | -43.42 | 3 | 5 | 1 | 68 | 304.823 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.10 | 1.04 | -11.01 | 2 | 5 | 0 | 67 | 303.815 | 2 | ↓ |