In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2008 | 35 | Yes |
Popular Name: 3-(4-chlorophenyl)-1-[(3,4-dimethoxyphenyl)methyl]-1-[2-(5-methoxy-1H-indol-3-yl)ethyl]urea 3-(4-chlorophenyl)-1-[(3,4-dimet…
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) | 5.40 | 12.23 | -18.7 | 2 | 7 | 0 | 76 | 493.991 | 9 | ↓ |
Popular Name: 1-[(4-chlorophenyl)methyl]-3-(2,4-dichlorophenyl)-1-[2-(5-methoxy-1H-indol-3-yl)ethyl]urea 1-[(4-chlorophenyl)methyl]-3-(2,…
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) | 7.04 | 13.92 | -16.42 | 2 | 5 | 0 | 57 | 502.829 | 7 | ↓ |
Popular Name: 1-[(4-tert-butylphenyl)methyl]-3-(4-chlorophenyl)-1-[2-(1H-indol-3-yl)ethyl]urea 1-[(4-tert-butylphenyl)methyl]-3…
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) | 7.43 | 16.04 | -10.98 | 2 | 4 | 0 | 48 | 460.021 | 7 | ↓ |
Popular Name: 1-(4-chlorobenzyl)-3-(3-chlorophenyl)-1-[2-(5-methoxy-1H-indol-3-yl)ethyl]urea 1-(4-chlorobenzyl)-3-(3-chloroph…
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) | 6.41 | 13.52 | -14.38 | 2 | 5 | 0 | 57 | 468.384 | 7 | ↓ |
Popular Name: 1-(3-benzoxybenzyl)-1-[2-(1H-indol-3-yl)ethyl]-3-(2-methoxyphenyl)urea 1-(3-benzoxybenzyl)-1-[2-(1H-ind…
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) | 6.68 | 15.57 | -17.94 | 2 | 6 | 0 | 67 | 505.618 | 10 | ↓ |